data_2owi_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 2owi _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 ' 3' ' ' VAL . . . . . . . . . . . . . 2.9 p . . . . . 0 C--O 1.233 0.228 0 CA-C-O 120.823 0.344 . . . . 0.0 110.275 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.1 m -96.19 149.89 36.49 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.046 178.05 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -51.0 -35.54 50.65 Favored 'Trans proline' 0 C--N 1.352 0.715 0 C-N-CA 122.88 2.387 . . . . 0.0 112.364 -179.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.489 ' O ' HG22 ' A' ' 9' ' ' VAL . 34.4 tt0 -59.78 -52.0 67.35 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.06 0.457 . . . . 0.0 110.408 176.678 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 32.8 tp10 -56.49 -39.22 72.91 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.641 177.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.96 -46.02 86.5 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 115.758 -0.656 . . . . 0.0 111.731 -179.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.489 HG22 ' O ' ' A' ' 6' ' ' GLU . 24.7 m -67.16 -28.32 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 CA-C-O 120.931 0.396 . . . . 0.0 110.229 -179.862 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -70.7 -32.05 69.13 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.227 175.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 53.2 m0 -66.4 -21.88 66.23 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 173.747 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -83.17 2.15 87.48 Favored Glycine 0 C--N 1.335 0.495 0 CA-C-N 115.707 -0.678 . . . . 0.0 112.915 -179.45 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -125.51 -41.33 2.02 Favored 'General case' 0 C--O 1.234 0.274 0 O-C-N 122.803 -0.234 . . . . 0.0 110.532 176.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 14.0 m -108.74 101.92 11.01 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 120.842 0.353 . . . . 0.0 110.983 -178.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -61.95 -39.7 93.02 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.459 -178.612 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -64.7 -31.63 72.94 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.525 178.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 62.5 tttp -70.5 -35.07 73.01 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 179.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.4 tp -62.15 -48.0 82.03 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.025 173.568 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.4 ' O ' ' HB2' ' A' ' 25' ' ' LEU . 60.2 tp -65.93 -49.07 69.26 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.624 -177.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 44.1 m -67.33 -29.43 69.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.788 -173.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -76.67 119.78 20.95 Favored 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 179.539 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -51.61 -39.19 57.54 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 121.088 0.471 . . . . 0.0 110.632 -176.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -66.78 -38.33 86.33 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.12 -179.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -71.95 -50.17 19.44 Favored Glycine 0 C--N 1.333 0.382 0 CA-C-N 115.505 -0.77 . . . . 0.0 111.955 -178.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.4 ' HB2' ' O ' ' A' ' 19' ' ' LEU . 7.9 tt -52.0 -43.16 63.52 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 122.787 0.435 . . . . 0.0 110.112 175.501 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.497 ' O ' ' HG3' ' A' ' 30' ' ' ARG . 13.6 tp10 -58.12 -56.07 26.79 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.466 178.179 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -60.76 -40.78 93.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.333 -177.281 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 62.8 t80 -69.71 -43.6 72.05 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.785 -175.004 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.428 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 11.6 t -67.9 -41.21 83.04 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 121.075 -0.25 . . . . 0.0 110.732 -178.466 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.497 ' HG3' ' O ' ' A' ' 26' ' ' GLU . 58.7 mtp180 -62.16 -43.22 99.33 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.974 0.416 . . . . 0.0 110.235 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.556 ' O ' HG23 ' A' ' 34' ' ' THR . 87.0 t80 -64.45 -47.13 80.22 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.978 175.816 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.435 HD23 ' HA ' ' A' ' 38' ' ' GLU . 12.2 tp -64.95 -21.83 66.9 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.86 -175.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.428 ' HG3' ' O ' ' A' ' 29' ' ' THR . 38.8 mttp -68.06 -29.98 69.08 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.713 178.591 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.556 HG23 ' O ' ' A' ' 31' ' ' PHE . 3.6 t -65.7 -21.93 66.58 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 120.871 0.367 . . . . 0.0 110.647 -177.208 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -118.56 7.44 11.8 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.819 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 56.2 t80 58.24 19.17 5.97 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.864 175.051 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 42.2 m -79.27 0.7 27.65 Favored 'General case' 0 C--N 1.327 -0.384 0 O-C-N 121.985 -0.447 . . . . 0.0 110.636 -178.216 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.45 ' HA ' HG22 ' A' ' 41' ' ' ILE . 7.5 pt-20 -59.26 -22.88 61.8 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.61 176.661 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -53.21 -45.98 68.85 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.665 176.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . 0.507 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 91.7 m-20 -64.4 -52.19 59.42 Favored 'General case' 0 C--O 1.241 0.654 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.633 -177.255 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.455 ' O ' HG13 ' A' ' 45' ' ' ILE . 13.0 tt -61.46 -44.7 99.01 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.155 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.369 -177.259 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.498 ' HA ' ' HB ' ' A' ' 45' ' ' ILE . 40.9 mt-10 -73.26 -21.19 60.66 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.101 -179.779 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.507 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 37.1 t80 -58.16 -60.5 3.66 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 120.614 0.245 . . . . 0.0 110.34 175.27 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.557 ' HB2' ' HG2' ' A' ' 105' ' ' GLN . 47.1 p-90 -75.77 -18.78 59.41 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 119.893 -0.723 . . . . 0.0 111.35 -177.667 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.498 ' HB ' ' HA ' ' A' ' 42' ' ' GLU . 41.4 mt -63.62 -41.51 92.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 169.656 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.07 -31.25 72.02 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.216 175.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.496 ' SG ' ' HA ' ' A' ' 44' ' ' TRP . 74.5 m -67.61 -32.73 73.66 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.433 176.812 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 55.0 mm-40 -71.52 -37.02 71.24 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 116.595 -0.275 . . . . 0.0 110.419 175.051 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -65.57 -36.74 84.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.422 0.629 . . . . 0.0 109.406 176.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.405 ' CZ ' HG21 ' A' ' 59' ' ' ILE . 50.4 t80 -62.67 -47.05 85.36 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 114.977 -1.01 . . . . 0.0 109.951 172.612 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.97 -22.72 65.88 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 115.386 -0.824 . . . . 0.0 111.163 178.405 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.437 ' HE2' ' HB3' ' A' ' 52' ' ' LYS . 32.4 ttpt -76.8 -18.45 58.41 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.916 -0.583 . . . . 0.0 111.032 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 22.6 t -66.39 159.51 26.78 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 121.11 0.481 . . . . 0.0 111.159 -176.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.3 15.95 2.59 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.743 179.089 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -104.13 105.77 2.66 Favored Glycine 0 CA--C 1.518 0.271 0 N-CA-C 111.096 -0.802 . . . . 0.0 111.096 177.022 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -48.58 -50.49 12.27 Favored 'Trans proline' 0 C--N 1.35 0.613 0 C-N-CA 123.017 2.478 . . . . 0.0 112.863 -176.004 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 3.6 pp0? -65.89 -34.52 78.32 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.77 0.319 . . . . 0.0 110.888 177.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -68.07 -30.22 69.36 Favored 'General case' 0 N--CA 1.461 0.112 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.934 -179.124 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.405 HG21 ' CZ ' ' A' ' 50' ' ' PHE . 40.8 mm -56.88 -43.56 80.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.199 176.424 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 21.6 m-70 -69.65 -42.05 74.74 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.568 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 85.9 mt -64.01 -44.55 92.26 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.802 -179.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -66.79 -46.81 74.1 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.552 179.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.62 -40.24 91.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.223 -178.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 38.2 mmtm -65.72 -37.51 86.61 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.739 178.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.8 -53.95 46.41 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.089 0.471 . . . . 0.0 109.963 176.117 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.411 ' HA ' ' HD1' ' A' ' 70' ' ' PHE . 69.9 mt -59.6 -35.05 57.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.366 178.778 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.464 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 40.1 t80 -57.92 -68.13 0.27 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.215 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -67.56 -33.74 75.65 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.446 -173.375 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.447 ' HA ' ' HD2' ' A' ' 76' ' ' PRO . 88.1 tttt -86.58 -29.13 22.85 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.958 -0.565 . . . . 0.0 112.098 -172.544 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . 0.411 ' HD1' ' HA ' ' A' ' 66' ' ' ILE . 96.1 m-85 -125.03 -53.4 1.64 Allowed 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -174.556 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.464 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 42.4 mm -64.28 -34.39 68.79 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -169.28 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.434 ' HA ' ' OE1' ' A' ' 72' ' ' GLN . 14.1 mm-40 -58.27 155.86 10.86 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.469 0.652 . . . . 0.0 111.968 -177.513 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.8 t -74.59 -28.65 61.01 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.009 179.233 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -87.51 -82.66 0.22 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.209 175.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . 57.19 158.66 0.08 OUTLIER Pre-proline 0 CA--C 1.542 0.636 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 174.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.447 ' HD2' ' HA ' ' A' ' 69' ' ' LYS . 64.2 Cg_endo -75.25 -16.34 19.72 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.31 2.006 . . . . 0.0 111.602 170.871 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -105.61 -51.81 2.93 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.418 177.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 64.51 93.59 0.06 Allowed 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.299 -175.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.401 ' C ' ' H ' ' A' ' 81' ' ' LEU . 65.5 t -86.29 141.92 13.79 Favored 'Isoleucine or valine' 0 C--O 1.237 0.443 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.759 -178.521 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 36.4 m-80 -78.14 23.41 0.28 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.42 -176.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.401 ' H ' ' C ' ' A' ' 79' ' ' VAL . 18.0 tp -65.57 142.81 57.97 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.964 177.825 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -48.57 140.11 8.52 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.64 -0.709 . . . . 0.0 112.067 -179.087 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 84.3 t80 -61.1 -52.89 62.98 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.387 -176.171 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 57.3 t60 -59.43 -38.59 81.08 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.869 0.366 . . . . 0.0 110.641 -177.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.436 ' O ' HG13 ' A' ' 89' ' ' ILE . 41.0 m -66.25 -51.62 55.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.76 -179.372 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.536 ' O ' HG21 ' A' ' 90' ' ' THR . 18.1 ptmt -67.29 -25.61 66.13 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.594 -177.64 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -64.08 -52.45 59.25 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-O 121.479 0.657 . . . . 0.0 109.405 175.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 99.0 t -58.95 -37.01 64.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.306 177.24 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.436 HG13 ' O ' ' A' ' 85' ' ' THR . 72.8 mt -66.98 -45.04 88.05 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.222 179.365 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.536 HG21 ' O ' ' A' ' 86' ' ' LYS . 48.4 p -57.34 -26.12 60.47 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 120.987 0.423 . . . . 0.0 110.757 -178.712 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -87.8 -41.42 13.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.148 175.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 22.5 t -79.51 -0.92 35.3 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.615 -174.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.9 tp -74.57 -4.53 5.78 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 CA-C-O 120.848 0.356 . . . . 0.0 111.552 -177.294 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 4.5 t -65.11 -47.18 78.08 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 116.686 -0.234 . . . . 0.0 110.881 179.048 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -132.23 81.35 61.41 Favored Pre-proline 0 N--CA 1.466 0.369 0 CA-C-O 121.161 0.505 . . . . 0.0 110.341 175.676 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_endo -71.43 139.62 35.01 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.746 2.298 . . . . 0.0 112.734 -176.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' THR . . . . . 0.411 ' H ' ' HB3' ' A' ' 100' ' ' SER . 35.4 p -87.18 172.93 9.55 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.419 173.509 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 41.7 tp -57.79 -36.61 72.42 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 121.189 0.519 . . . . 0.0 110.778 -179.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' HIS . . . . . 0.496 ' HB3' ' HB3' ' A' ' 102' ' ' ASP . 33.8 m-70 -113.28 38.87 2.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.12 177.174 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' SER . . . . . 0.411 ' HB3' ' H ' ' A' ' 97' ' ' THR . 9.2 p -55.39 -38.78 69.34 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.053 0.454 . . . . 0.0 111.422 -179.833 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 -93.95 21.84 6.29 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.409 -177.342 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . 0.496 ' HB3' ' HB3' ' A' ' 99' ' ' HIS . 7.3 p-10 -63.99 -35.29 80.2 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 120.976 0.417 . . . . 0.0 110.192 -179.451 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.48 ' O ' ' HG2' ' A' ' 107' ' ' ARG . . . -63.42 -48.47 77.66 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.887 174.795 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -58.33 -43.1 88.07 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.505 179.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.557 ' HG2' ' HB2' ' A' ' 44' ' ' TRP . 0.9 OUTLIER -57.06 -53.16 61.27 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.778 178.397 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 47.4 m -58.47 -48.17 81.64 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.165 -178.793 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . 0.48 ' HG2' ' O ' ' A' ' 103' ' ' ALA . 29.9 mmt180 -56.64 -65.05 0.68 Allowed 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.958 0.409 . . . . 0.0 110.886 -178.578 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.415 ' O ' ' HG3' ' A' ' 112' ' ' MET . 63.5 t -58.46 -38.57 70.92 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.4 -174.184 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 86.8 t80 -56.52 -56.6 19.22 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.77 179.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 1.1 pp0? -75.29 -12.89 60.37 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.629 -0.259 . . . . 0.0 111.237 -177.375 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.4 ' HG ' ' O ' ' A' ' 107' ' ' ARG . 53.4 mt -72.8 -45.56 57.88 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 173.266 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' MET . . . . . 0.415 ' HG3' ' O ' ' A' ' 108' ' ' VAL . 33.6 mtm -61.96 -34.81 76.81 Favored 'General case' 0 CA--C 1.52 -0.191 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 178.428 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . 0.556 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 3.9 tm-20 -56.81 -68.76 0.19 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.178 177.544 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -63.75 -19.43 64.95 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.866 -0.607 . . . . 0.0 112.305 -174.127 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -101.14 -71.33 0.71 Allowed 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 120.991 0.424 . . . . 0.0 111.523 -179.049 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 7.4 m -79.4 -33.54 42.64 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.068 -0.515 . . . . 0.0 112.136 -171.335 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . 0.556 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 41.4 t80 -75.24 -30.9 60.65 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.662 0.268 . . . . 0.0 110.773 -173.235 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 32.8 p -64.16 -56.21 16.38 Favored 'General case' 0 C--O 1.24 0.598 0 CA-C-O 120.991 0.424 . . . . 0.0 110.642 177.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 9.4 ptp85 -60.81 -32.48 71.84 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.021 177.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -60.77 -40.29 91.98 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.538 177.562 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 92.5 mt -71.62 -26.92 62.77 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.746 -178.318 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 16.4 tppt? -106.75 7.05 30.18 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 120.966 0.413 . . . . 0.0 111.342 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 86.9 p -74.8 156.61 36.33 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 110.249 -0.278 . . . . 0.0 110.249 178.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -58.74 -24.67 62.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.164 175.064 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 50.8 mm -61.92 -56.53 17.12 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.576 178.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 66.3 t80 -72.34 -37.75 68.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.548 -177.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 80.8 mt -63.81 -30.16 71.28 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.299 177.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -66.65 -38.73 87.48 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.091 174.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 98.8 mt -66.03 -28.59 68.98 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.301 176.069 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' MET . . . . . 0.572 ' HE2' ' HA ' ' A' ' 130' ' ' MET . 26.6 mmt . . . . . 0 C--O 1.234 0.243 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.732 179.187 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 13.3 p . . . . . 0 C--O 1.235 0.29 0 CA-C-O 120.79 0.329 . . . . 0.0 110.35 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.7 m -66.11 135.62 95.16 Favored Pre-proline 0 CA--C 1.535 0.387 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.261 175.391 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -49.01 -29.58 16.01 Favored 'Trans proline' 0 C--N 1.354 0.864 0 C-N-CA 123.038 2.492 . . . . 0.0 112.281 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -52.61 -59.96 3.83 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.748 177.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.51 ' HA ' ' HB3' ' A' ' 10' ' ' LYS . 25.5 tt0 -79.82 -22.67 42.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.823 -177.614 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -56.9 -46.49 81.9 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 120.87 0.367 . . . . 0.0 110.304 176.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 33.7 m -76.16 -29.04 19.01 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.382 177.119 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.51 ' HB3' ' HA ' ' A' ' 7' ' ' GLU . 16.2 tppt? -65.08 -27.51 68.82 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.808 176.606 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 43.6 m0 -65.96 -27.52 68.22 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 120.682 0.277 . . . . 0.0 110.615 175.477 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -61.6 -12.55 34.23 Favored Glycine 0 CA--C 1.52 0.371 0 CA-C-N 115.728 -0.669 . . . . 0.0 114.209 -173.047 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' A' ' 10' ' ' LYS . 12.0 pt-20 -104.36 -14.85 15.61 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 117.367 0.583 . . . . 0.0 111.901 -178.605 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.538 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 19.3 m -145.21 95.03 2.61 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-O 120.987 0.423 . . . . 0.0 111.901 -173.339 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.452 ' O ' ' HB3' ' A' ' 18' ' ' LEU . 15.9 t80 -54.86 -32.24 60.53 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.377 0.608 . . . . 0.0 109.884 175.122 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -57.15 -50.37 73.04 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.425 176.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.538 ' HG2' ' O ' ' A' ' 14' ' ' SER . 13.0 ptmm? -69.99 -22.86 63.09 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 120.81 -0.356 . . . . 0.0 110.081 -175.865 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.452 ' HB3' ' O ' ' A' ' 15' ' ' PHE . 62.8 tp -59.55 -54.7 43.47 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.917 174.921 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -68.44 -34.72 76.49 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.655 177.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.441 ' HB3' ' HA ' ' A' ' 17' ' ' LYS . 23.9 t -64.43 -25.09 67.86 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.508 179.376 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 16.2 t-80 -88.84 113.66 24.63 Favored 'General case' 0 C--O 1.223 -0.29 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 177.565 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 8.4 ptm180 -47.23 -45.27 23.38 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-O 120.782 0.325 . . . . 0.0 111.601 -176.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -67.59 -34.46 77.06 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.068 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -72.37 -41.67 51.67 Favored Glycine 0 C--N 1.331 0.282 0 N-CA-C 111.396 -0.682 . . . . 0.0 111.396 -179.194 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 7.3 tt -60.0 -41.85 93.0 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 174.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.459 ' O ' ' HG3' ' A' ' 30' ' ' ARG . 30.2 tt0 -60.3 -55.5 32.95 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.77 176.676 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -56.75 -43.85 81.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.332 -178.301 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 80.2 t80 -68.45 -43.33 77.3 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.06 -176.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.454 HG21 ' O ' ' A' ' 26' ' ' GLU . 12.5 t -67.04 -35.7 80.47 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 120.665 -0.414 . . . . 0.0 110.083 -179.439 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.459 ' HG3' ' O ' ' A' ' 26' ' ' GLU . 43.4 mtp180 -64.74 -45.46 86.38 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 121.085 0.469 . . . . 0.0 109.753 176.23 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 80.1 t80 -62.43 -42.04 99.17 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.565 177.316 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.407 ' HA ' ' HB3' ' A' ' 35' ' ' GLU . 16.2 tp -75.42 -22.09 57.66 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.501 -176.438 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.514 ' HE2' ' HG3' ' A' ' 38' ' ' GLU . 1.5 mptm? -71.68 -47.26 55.36 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.013 174.31 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 14.5 t -73.46 -18.3 61.14 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 120.854 0.359 . . . . 0.0 110.085 177.538 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.407 ' HB3' ' HA ' ' A' ' 32' ' ' LEU . 10.2 tp10 -75.11 -25.05 58.2 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.318 171.445 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 33.9 t80 68.39 33.57 4.09 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.128 177.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.1 m -136.43 30.46 2.92 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.553 -178.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.514 ' HG3' ' HE2' ' A' ' 33' ' ' LYS . 0.1 OUTLIER -70.52 -11.49 60.96 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.009 -0.542 . . . . 0.0 111.193 -177.91 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -45.25 -37.32 4.58 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.275 176.372 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . 0.601 HD22 ' HB2' ' A' ' 80' ' ' ASN . 4.4 m-20 -69.36 -50.54 45.26 Favored 'General case' 0 C--O 1.242 0.662 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.896 -178.671 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.466 HG23 ' O ' ' A' ' 38' ' ' GLU . 11.2 tt -64.83 -42.92 96.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 C-N-CA 121.021 -0.272 . . . . 0.0 110.281 -175.215 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.413 ' HA ' ' HB ' ' A' ' 45' ' ' ILE . 51.8 mt-10 -69.22 -25.36 64.27 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.433 -0.348 . . . . 0.0 110.482 178.783 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.483 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 78.1 t80 -57.54 -60.9 2.96 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.726 178.38 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.725 ' HA ' ' SG ' ' A' ' 47' ' ' CYS . 43.1 p-90 -78.78 -17.01 56.44 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 119.779 -0.769 . . . . 0.0 111.82 -178.336 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.413 ' HB ' ' HA ' ' A' ' 42' ' ' GLU . 30.7 mt -63.85 -38.51 82.53 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 168.268 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.71 -34.69 67.3 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.1 178.474 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.725 ' SG ' ' HA ' ' A' ' 44' ' ' TRP . 18.2 p -72.25 -23.67 61.25 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-O 120.562 0.22 . . . . 0.0 110.502 -179.252 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -67.97 -52.46 35.72 Favored 'General case' 0 CA--C 1.521 -0.139 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 170.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -55.92 -27.72 53.55 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.795 -0.638 . . . . 0.0 110.311 175.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.531 ' HA ' ' HD2' ' A' ' 62' ' ' LYS . 49.9 t80 -69.62 -50.35 45.23 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.991 178.052 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 64.8 pttt -72.52 -21.14 61.23 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 121.252 0.548 . . . . 0.0 110.157 178.684 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -74.68 -38.32 62.43 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.959 -176.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.8 p -63.24 128.68 36.93 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.905 0.383 . . . . 0.0 110.319 176.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -102.35 -1.75 30.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.206 -174.694 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -88.38 115.1 4.34 Favored Glycine 0 CA--C 1.521 0.457 0 C-N-CA 121.109 -0.567 . . . . 0.0 111.848 177.677 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -53.69 -33.84 71.45 Favored 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 122.886 2.391 . . . . 0.0 112.374 -178.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 58.2 mt-30 -65.47 -49.26 69.74 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.598 178.355 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -59.2 -38.53 80.12 Favored 'General case' 0 N--CA 1.461 0.109 0 CA-C-N 115.0 -1.0 . . . . 0.0 110.534 179.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.424 ' O ' ' HE1' ' A' ' 50' ' ' PHE . 43.1 mm -54.38 -53.83 26.93 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.039 178.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.457 ' HA ' ' HG2' ' A' ' 96' ' ' PRO . 17.6 m-70 -63.39 -46.95 84.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.317 -176.325 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 88.8 mt -67.52 -44.05 79.33 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.114 -176.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.531 ' HD2' ' HA ' ' A' ' 50' ' ' PHE . 40.1 ttmt -64.17 -41.01 97.3 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.543 -178.819 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.26 -41.1 92.54 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.416 178.122 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 65.5 tttm -65.88 -38.06 87.79 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.128 178.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.18 -52.14 64.98 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.385 176.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 75.4 mt -59.34 -35.99 61.38 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 CA-C-O 121.257 0.551 . . . . 0.0 110.014 178.136 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 90.2 t80 -58.43 -60.95 2.99 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.58 178.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -70.19 -18.21 63.18 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.886 -174.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 85.4 tttt -97.24 -28.76 13.93 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 111.887 0.328 . . . . 0.0 111.887 -174.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 70.9 m-85 -130.83 -46.45 1.04 Allowed 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 -173.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 48.0 mm -74.51 -34.2 34.89 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 CA-C-O 121.085 0.469 . . . . 0.0 111.392 -173.296 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.547 ' NE2' ' HB3' ' A' ' 74' ' ' ASP . 0.0 OUTLIER -61.39 137.47 58.24 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.328 -174.386 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 22.9 m -66.01 -24.22 66.72 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 121.387 0.613 . . . . 0.0 109.67 174.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . 0.547 ' HB3' ' NE2' ' A' ' 72' ' ' GLN . 20.8 t70 -106.05 86.26 2.34 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 169.763 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -137.95 152.49 72.25 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.122 -179.517 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_exo -46.8 -48.81 13.4 Favored 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 123.124 2.55 . . . . 0.0 112.857 -178.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.429 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 94.0 mttt -116.32 -37.0 3.86 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.219 178.755 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.429 ' HB2' ' O ' ' A' ' 77' ' ' LYS . 44.0 mt-10 66.49 -177.47 0.2 Allowed 'General case' 0 C--O 1.234 0.279 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 -164.024 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.421 HG22 ' HD1' ' A' ' 43' ' ' PHE . 69.4 t -144.32 141.17 24.39 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 N-CA-C 110.339 -0.245 . . . . 0.0 110.339 177.463 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.601 ' HB2' HD22 ' A' ' 40' ' ' ASN . 34.7 m-80 -64.66 80.91 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.049 176.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 36.6 tp -127.5 143.73 51.15 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.432 -0.803 . . . . 0.0 109.741 179.011 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -50.38 132.2 24.62 Favored 'General case' 0 N--CA 1.466 0.371 0 O-C-N 123.427 0.454 . . . . 0.0 111.193 177.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -62.55 -38.2 89.13 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.911 -177.433 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . 0.459 ' O ' HG22 ' A' ' 88' ' ' VAL . 84.7 t60 -65.41 -36.94 85.47 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 179.005 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 48.3 m -66.38 -41.39 89.46 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.127 175.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -60.95 -41.37 96.18 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 175.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -57.66 -44.1 85.46 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.656 178.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.459 HG22 ' O ' ' A' ' 84' ' ' HIS . 99.4 t -56.93 -44.74 82.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.114 176.203 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 71.8 mt -70.23 -38.19 73.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.321 -177.224 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 41.7 p -65.05 -26.67 68.35 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 120.682 0.277 . . . . 0.0 111.063 -177.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 47.8 m-80 -86.31 -46.05 10.67 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.897 175.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 21.8 m -82.01 -3.61 54.88 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 -173.72 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 7.9 tp -56.38 -23.07 15.82 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 CA-C-O 120.975 0.417 . . . . 0.0 111.342 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 11.6 t -64.1 -33.64 76.22 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.417 -179.081 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 17.2 mm-40 -140.5 76.64 24.72 Favored Pre-proline 0 N--CA 1.466 0.34 0 CA-C-O 120.748 0.309 . . . . 0.0 110.251 -178.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . 0.457 ' HG2' ' HA ' ' A' ' 60' ' ' HIS . 72.0 Cg_endo -76.97 138.26 18.26 Favored 'Trans proline' 0 CA--C 1.531 0.371 0 C-N-CA 122.538 2.159 . . . . 0.0 112.085 179.776 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 5.8 m -105.82 162.72 13.3 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.422 -179.091 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -15.75 -57.87 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 125.037 1.335 . . . . 0.0 114.006 -177.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 58.6 t60 -146.23 35.83 1.0 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.874 -1.057 . . . . 0.0 109.593 -163.25 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 25.0 t -61.0 -10.99 6.68 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 114.973 -1.012 . . . . 0.0 112.071 -175.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 81.6 m-85 -87.34 14.64 7.59 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.805 -0.179 . . . . 0.0 111.221 178.289 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -59.01 -44.53 91.71 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 120.823 0.344 . . . . 0.0 110.811 -179.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.91 -42.07 97.33 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 121.221 0.534 . . . . 0.0 110.379 177.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.54 -39.34 91.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.631 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -60.47 -44.23 96.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.216 178.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 36.6 t -58.93 -52.12 67.1 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.326 178.191 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . 0.438 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 19.4 mmt180 -54.54 -61.37 2.35 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.159 -179.573 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.433 HG23 ' CD2' ' A' ' 43' ' ' PHE . 59.2 t -57.94 -46.43 87.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.569 -0.742 . . . . 0.0 112.052 -173.785 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 68.3 t80 -57.71 -52.72 64.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.983 -178.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . 0.438 ' HG3' ' O ' ' A' ' 107' ' ' ARG . 0.0 OUTLIER -71.93 -31.76 66.67 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.929 0.395 . . . . 0.0 110.887 -176.381 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 31.9 tp -68.94 -38.5 79.53 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.952 -175.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' MET . . . . . 0.433 ' HB3' HD21 ' A' ' 40' ' ' ASN . 24.4 ptt? -82.4 -22.25 35.46 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 176.709 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . 0.678 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 37.2 tt0 -61.82 -59.61 4.88 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.141 178.27 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -49.14 -35.42 16.52 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.195 -176.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -104.92 -65.93 1.01 Allowed 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 -175.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 33.3 t -63.92 -36.57 84.38 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 111.698 0.258 . . . . 0.0 111.698 -173.139 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . 0.678 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 15.5 t80 -70.0 -40.23 75.41 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 120.453 0.168 . . . . 0.0 110.925 -177.867 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 28.8 p -65.63 -44.26 87.01 Favored 'General case' 0 C--O 1.241 0.648 0 CA-C-O 121.186 0.517 . . . . 0.0 109.966 176.27 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 75.1 mtp85 -57.24 -40.15 77.01 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.077 174.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -61.43 -40.76 95.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.095 176.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 89.8 mt -68.88 -8.96 48.88 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.202 179.286 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . 0.671 ' HB2' ' HZ2' ' A' ' 122' ' ' LYS . 0.1 OUTLIER -130.65 20.32 5.11 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 120.917 0.389 . . . . 0.0 111.44 173.608 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 89.1 p -65.92 161.93 20.21 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.949 176.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 15.5 p-10 -62.76 -43.66 98.21 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.354 -179.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 7.7 tp -62.61 -39.22 83.81 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.607 178.338 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' TYR . . . . . 0.431 ' O ' ' HG2' ' A' ' 130' ' ' MET . 58.0 t80 -66.8 -40.43 88.08 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 110.131 -0.322 . . . . 0.0 110.131 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 83.3 mt -61.74 -37.18 83.27 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.311 177.151 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -62.66 -43.17 99.5 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.188 175.153 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 95.1 mt -63.73 -30.0 71.15 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.606 176.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' MET . . . . . 0.672 ' HA ' ' HE1' ' A' ' 130' ' ' MET . 21.4 mmt . . . . . 0 N--CA 1.464 0.257 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.619 177.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.7 p . . . . . 0 C--O 1.233 0.193 0 CA-C-O 120.785 0.326 . . . . 0.0 110.319 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 34.8 t -88.91 148.11 40.51 Favored Pre-proline 0 C--N 1.327 -0.404 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 177.052 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_endo -48.62 -33.24 23.52 Favored 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 122.839 2.359 . . . . 0.0 111.869 179.286 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.521 ' O ' HG23 ' A' ' 9' ' ' VAL . 36.3 mt-10 -63.14 -54.16 42.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.143 178.035 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -63.3 -29.29 70.64 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.081 0.467 . . . . 0.0 109.959 178.03 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.22 -40.04 82.2 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.358 -179.348 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.521 HG23 ' O ' ' A' ' 6' ' ' GLU . 25.5 m -71.51 -21.92 21.75 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.269 0 C-N-CA 120.489 -0.484 . . . . 0.0 110.024 177.347 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.575 ' O ' ' HG2' ' A' ' 13' ' ' GLU . 5.6 mptp? -69.52 -16.37 63.42 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.852 173.186 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 42.8 m0 -80.3 -16.46 54.58 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.767 -0.456 . . . . 0.0 109.767 174.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -96.02 13.69 65.66 Favored Glycine 0 C--N 1.334 0.45 0 CA-C-N 115.708 -0.678 . . . . 0.0 112.858 -178.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.575 ' HG2' ' O ' ' A' ' 10' ' ' LYS . 11.5 pt-20 -111.78 -28.38 8.11 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 120.881 0.372 . . . . 0.0 110.457 175.708 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.8 m -152.6 117.51 5.12 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.322 -177.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 12.3 t80 -56.58 -36.84 69.8 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 172.223 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -52.19 -45.2 65.09 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 115.069 -0.969 . . . . 0.0 110.858 175.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.538 ' HD2' ' O ' ' A' ' 10' ' ' LYS . 40.4 ttmt -70.19 -36.29 74.52 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.301 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 67.3 tp -58.82 -43.41 90.64 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.078 176.259 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 51.5 tp -74.02 -34.71 64.22 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.574 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 33.6 t -63.81 -28.94 70.21 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.533 179.168 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -84.49 115.64 22.68 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 175.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.623 ' NH1' ' HB3' ' A' ' 22' ' ' ARG . 4.6 ttp-105 -56.49 -31.63 64.23 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 176.438 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -64.06 -46.71 83.16 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.397 176.38 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -62.93 -44.62 97.14 Favored Glycine 0 N--CA 1.45 -0.393 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.658 179.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 13.3 tp -52.36 -57.39 9.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.144 0.497 . . . . 0.0 110.475 174.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -58.74 -39.49 81.04 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-N 115.25 -0.886 . . . . 0.0 111.199 -175.434 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -71.4 -45.47 62.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.022 0.439 . . . . 0.0 110.976 179.017 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.47 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 74.2 t80 -72.98 -30.28 63.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.226 -174.876 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 13.6 t -76.02 -39.09 56.44 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 -177.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 37.2 ttt180 -59.72 -39.37 84.45 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.905 171.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.5 ' O ' HG22 ' A' ' 34' ' ' THR . 68.0 t80 -62.59 -53.45 54.39 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.822 -178.502 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.581 HD12 ' HA ' ' A' ' 38' ' ' GLU . 2.7 pp -73.91 -16.12 61.11 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 120.761 0.315 . . . . 0.0 111.406 -179.493 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.599 ' HD2' ' HB3' ' A' ' 38' ' ' GLU . 12.7 mptt -65.38 -50.23 66.32 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 120.962 0.41 . . . . 0.0 110.086 175.785 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.5 HG22 ' O ' ' A' ' 31' ' ' PHE . 13.8 t -68.66 -17.96 64.19 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.885 -174.262 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.537 ' HG2' ' HA ' ' A' ' 32' ' ' LEU . 12.5 pt-20 -97.56 8.76 44.05 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.736 0.303 . . . . 0.0 110.631 176.974 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 91.7 m-85 57.96 39.58 26.42 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.727 173.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 26.1 m -124.81 34.59 4.96 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.446 0.641 . . . . 0.0 109.3 177.179 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.599 ' HB3' ' HD2' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -83.43 -30.75 27.06 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.13 -0.941 . . . . 0.0 112.857 -170.079 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.635 ' HB3' ' HZ3' ' A' ' 77' ' ' LYS . 0.4 OUTLIER -57.71 -22.25 45.27 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 120.823 -0.351 . . . . 0.0 110.9 -177.058 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . 0.523 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 58.1 m-80 -66.74 -50.46 62.69 Favored 'General case' 0 C--O 1.239 0.514 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.435 179.06 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.425 HG22 ' O ' ' A' ' 38' ' ' GLU . 13.9 tt -69.38 -40.67 80.31 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 C-N-CA 120.916 -0.314 . . . . 0.0 110.191 -178.751 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -61.69 -30.94 71.07 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.404 175.128 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.523 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 78.4 t80 -59.87 -66.58 0.49 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.405 179.603 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.615 ' HB2' ' HG3' ' A' ' 105' ' ' GLN . 47.2 p-90 -75.55 -18.5 59.75 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 120.176 -0.61 . . . . 0.0 112.516 -171.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 13.0 tt -73.39 -32.8 38.42 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 173.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.56 -27.69 65.34 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.927 -0.578 . . . . 0.0 109.904 174.346 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.479 ' SG ' ' HB2' ' A' ' 101' ' ' PHE . 41.4 t -68.83 -42.96 76.49 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.181 175.134 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 18.2 tp10 -65.1 -36.95 85.92 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 176.317 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.569 ' HA ' ' HE3' ' A' ' 52' ' ' LYS . 10.4 t70 -64.9 -38.26 90.38 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.378 173.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.494 ' HA ' ' HE2' ' A' ' 62' ' ' LYS . 8.5 t80 -56.15 -39.89 73.01 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.626 177.375 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.601 ' HB2' ' NZ ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -97.47 -5.28 36.37 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.826 0.676 . . . . 0.0 112.826 -173.656 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.569 ' HE3' ' HA ' ' A' ' 49' ' ' ASP . 18.4 ptpt -74.38 -28.4 61.09 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 175.267 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.2 p -74.24 150.5 40.26 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.982 174.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.64 4.7 5.54 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 111.678 0.251 . . . . 0.0 111.678 -177.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . 0.481 ' O ' HG12 ' A' ' 59' ' ' ILE . . . -75.12 120.44 6.2 Favored Glycine 0 CA--C 1.52 0.372 0 N-CA-C 111.169 -0.772 . . . . 0.0 111.169 175.652 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . 0.446 ' O ' ' HD2' ' A' ' 60' ' ' HIS . 72.0 Cg_exo -49.0 -62.3 0.45 Allowed 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 122.878 2.386 . . . . 0.0 112.777 -175.498 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.83 -34.52 74.68 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 120.903 0.382 . . . . 0.0 110.519 -179.224 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.42 HE21 ' HD2' ' A' ' 62' ' ' LYS . 56.3 tp60 -60.65 -41.39 94.91 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.955 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.481 HG12 ' O ' ' A' ' 55' ' ' GLY . 44.2 mm -59.0 -41.44 83.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.683 179.096 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.446 ' HD2' ' O ' ' A' ' 56' ' ' PRO . 77.6 m-70 -64.95 -50.46 66.3 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.443 -177.237 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.45 HD13 ' N ' ' A' ' 62' ' ' LYS . 4.4 pp -70.54 -31.02 67.92 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.476 -175.309 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.494 ' HE2' ' HA ' ' A' ' 50' ' ' PHE . 60.5 mtpt -71.93 -41.73 67.49 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 120.777 0.323 . . . . 0.0 110.299 176.82 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.461 ' HB1' ' CE1' ' A' ' 50' ' ' PHE . . . -60.85 -44.69 96.67 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.691 178.427 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -65.51 -41.12 93.52 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.629 -177.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.99 -50.54 73.7 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-O 121.067 0.46 . . . . 0.0 110.567 177.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 70.1 mt -62.57 -38.19 80.85 Favored 'Isoleucine or valine' 0 C--O 1.231 0.127 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.327 178.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.547 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 49.1 t80 -55.74 -59.84 4.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.635 178.073 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -67.55 -24.61 65.55 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.427 -0.806 . . . . 0.0 112.603 -170.543 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -105.49 -25.41 12.34 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -176.051 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . 0.522 ' HB3' ' HD1' ' A' ' 43' ' ' PHE . 96.4 m-85 -125.04 -46.12 1.83 Allowed 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 112.678 0.622 . . . . 0.0 112.678 -171.725 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.547 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 48.4 mm -71.04 -37.93 69.62 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 CA-C-O 120.944 0.402 . . . . 0.0 110.647 -173.473 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.8 tp60 -72.64 129.41 38.19 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.227 179.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 27.2 m -60.17 -44.1 95.31 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.204 0.526 . . . . 0.0 110.103 178.077 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -74.82 79.33 2.1 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.152 175.254 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -132.3 156.82 79.64 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.727 -175.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -67.74 -30.32 34.34 Favored 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 122.704 2.269 . . . . 0.0 112.259 -179.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.635 ' HZ3' ' HB3' ' A' ' 39' ' ' GLU . 26.0 tptp -105.0 -39.4 6.26 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.981 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.421 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 51.5 mt-10 69.3 154.27 0.11 Allowed 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.297 -177.377 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.423 HG21 ' CD1' ' A' ' 43' ' ' PHE . 88.2 t -140.05 147.86 23.25 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.496 175.603 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -86.79 87.75 7.52 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.122 0.487 . . . . 0.0 109.97 178.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.476 HD13 HG22 ' A' ' 85' ' ' THR . 37.3 tp -134.86 145.67 48.51 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.79 -177.853 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -54.73 158.9 2.42 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-N 115.683 -0.69 . . . . 0.0 112.487 -177.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 55.7 m-85 -73.69 -57.25 4.11 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.79 -177.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . 0.436 ' O ' HG23 ' A' ' 88' ' ' VAL . 86.3 t60 -64.27 -31.03 72.08 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.996 -175.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.476 HG22 HD13 ' A' ' 81' ' ' LEU . 76.0 m -59.61 -51.76 68.43 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.67 179.205 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 9.7 ptpp? -71.24 -25.27 62.41 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.263 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -63.53 -41.64 98.47 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 121.231 0.539 . . . . 0.0 110.233 176.047 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.436 HG23 ' O ' ' A' ' 84' ' ' HIS . 81.3 t -64.06 -37.97 81.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 121.25 0.547 . . . . 0.0 109.66 174.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 75.6 mt -66.14 -40.3 86.71 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.258 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 40.2 p -61.78 -36.13 80.16 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 120.991 0.424 . . . . 0.0 110.376 179.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 28.7 m-80 -73.68 -29.23 62.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.903 175.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 50.5 m -94.8 -2.7 50.39 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -175.593 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 9.9 tp -61.35 -27.58 42.18 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.384 0 CA-C-O 120.874 0.369 . . . . 0.0 110.924 -177.269 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 15.0 t -78.97 -18.29 53.98 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.099 -178.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -140.58 75.66 26.01 Favored Pre-proline 0 N--CA 1.465 0.313 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.28 -179.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -75.08 143.07 28.36 Favored 'Trans proline' 0 C--O 1.236 0.377 0 C-N-CA 122.398 2.065 . . . . 0.0 111.688 178.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 3.4 m -130.09 168.43 16.78 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 -178.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.403 ' N ' HD21 ' A' ' 98' ' ' LEU . 3.2 mm? -64.71 3.73 0.49 Allowed 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 -170.119 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -157.14 19.72 0.3 Allowed 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 118.485 0.584 . . . . 0.0 111.854 174.301 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 30.0 m -55.21 -37.1 66.69 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 121.035 0.445 . . . . 0.0 111.789 -178.071 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.479 ' HB2' ' SG ' ' A' ' 47' ' ' CYS . 10.7 m-85 -89.79 16.89 7.27 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.519 -175.416 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -69.83 -32.96 71.67 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 120.85 0.357 . . . . 0.0 110.51 -177.606 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.9 -43.94 97.82 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 121.188 0.518 . . . . 0.0 109.943 176.148 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.13 -42.72 96.71 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.033 177.146 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.615 ' HG3' ' HB2' ' A' ' 44' ' ' TRP . 57.4 tt0 -57.34 -42.7 82.46 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.406 177.721 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 46.7 t -63.17 -53.22 56.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.996 -179.577 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . 0.432 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 20.0 mmm180 -57.21 -44.81 84.04 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.86 -174.342 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 57.7 t -77.26 -37.32 25.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.144 -175.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -60.57 -52.35 65.55 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.595 176.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . 0.432 ' HG3' ' O ' ' A' ' 107' ' ' ARG . 0.0 OUTLIER -64.53 -31.31 72.47 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.064 0.459 . . . . 0.0 110.298 -178.745 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.403 ' HB2' ' O ' ' A' ' 107' ' ' ARG . 31.7 tp -65.74 -44.01 87.25 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.831 -176.579 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' MET . . . . . 0.495 ' HE2' ' HE1' ' A' ' 44' ' ' TRP . 28.1 mtm -72.49 -34.53 67.74 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 177.157 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . 0.587 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 7.1 tm-20 -57.56 -63.3 1.28 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.552 -178.328 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -54.8 -26.04 32.18 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.115 -0.493 . . . . 0.0 112.128 -174.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -103.66 -74.26 0.65 Allowed 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 120.803 0.335 . . . . 0.0 111.795 -176.459 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 15.6 t -64.84 -31.94 73.41 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.923 -170.442 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . 0.587 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 38.3 t80 -63.85 -40.88 97.6 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.617 0.246 . . . . 0.0 111.051 -176.743 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 63.5 p -61.72 -45.92 91.87 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-O 121.536 0.684 . . . . 0.0 109.965 179.177 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 52.8 mtp180 -59.58 -41.27 89.87 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.145 176.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 77.6 t80 -59.53 -34.2 72.34 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.46 179.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 94.5 mt -71.05 -26.01 62.9 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.161 178.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -115.89 21.43 13.82 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.393 177.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 97.9 p -75.7 152.21 37.53 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 120.645 0.26 . . . . 0.0 110.785 179.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -61.48 -29.14 69.78 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.353 0.597 . . . . 0.0 109.4 176.038 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.413 ' O ' ' HG ' ' A' ' 129' ' ' LEU . 45.2 mm -61.24 -52.93 55.69 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 115.087 -0.96 . . . . 0.0 110.21 174.343 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' TYR . . . . . 0.419 ' O ' ' HG2' ' A' ' 130' ' ' MET . 53.0 t80 -62.73 -38.74 91.68 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.587 -177.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 97.7 mt -60.77 -33.69 73.34 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.323 177.538 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -74.65 -34.3 62.7 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.373 177.192 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 125' ' ' ILE . 85.7 mt -71.26 -18.24 62.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.61 178.275 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' MET . . . . . 0.696 ' HE2' ' HA ' ' A' ' 130' ' ' MET . 21.6 mmt . . . . . 0 CA--C 1.533 0.321 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.913 178.634 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . 0.44 HG21 ' CZ2' ' A' ' 11' ' ' TRP . 7.1 p . . . . . 0 C--O 1.235 0.333 0 CA-C-O 120.88 0.371 . . . . 0.0 111.502 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.7 m -76.83 151.54 82.32 Favored Pre-proline 0 C--O 1.236 0.362 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.334 176.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -53.59 -34.89 75.1 Favored 'Trans proline' 0 C--N 1.351 0.67 0 C-N-CA 122.877 2.385 . . . . 0.0 112.652 -177.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 46.3 mm-40 -60.48 -52.87 63.35 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.966 -179.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.515 ' HA ' ' HE2' ' A' ' 10' ' ' LYS . 22.1 tp10 -65.27 -37.8 88.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.074 178.565 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.07 -53.56 57.0 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.232 -179.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.78 HG11 ' SD ' ' A' ' 130' ' ' MET . 22.9 m -66.94 -25.55 34.68 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-O 121.26 0.553 . . . . 0.0 110.572 -179.589 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.539 ' HG2' ' HE2' ' A' ' 17' ' ' LYS . 35.2 ttpt -76.14 -9.52 58.69 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.396 -175.618 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . 0.44 ' CZ2' HG21 ' A' ' 3' ' ' VAL . 45.9 m0 -66.98 -18.22 65.28 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.419 0.152 . . . . 0.0 111.1 177.773 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -76.26 60.87 3.13 Favored Glycine 0 C--N 1.333 0.374 0 CA-C-N 116.098 -0.501 . . . . 0.0 112.829 -177.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -150.74 -39.41 0.13 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.0 0.429 . . . . 0.0 110.34 176.322 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.405 ' HB3' ' OD1' ' A' ' 16' ' ' ASP . 69.3 m -142.1 125.08 16.17 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.678 -176.649 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.403 ' CZ ' ' SD ' ' A' ' 112' ' ' MET . 33.9 t80 -58.95 -40.21 84.01 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.028 178.489 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.405 ' OD1' ' HB3' ' A' ' 14' ' ' SER . 7.9 p-10 -64.66 -29.74 70.75 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.641 -0.708 . . . . 0.0 110.862 179.509 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.539 ' HE2' ' HG2' ' A' ' 10' ' ' LYS . 65.7 tttp -65.87 -38.22 88.21 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 121.163 0.506 . . . . 0.0 109.828 176.84 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.448 HD23 ' HB2' ' A' ' 28' ' ' PHE . 54.5 tp -59.91 -48.05 83.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.248 176.467 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -72.55 -25.56 61.4 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.178 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 30.2 t -60.02 -27.73 67.15 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 121.326 0.584 . . . . 0.0 109.572 176.119 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 71.5 m-70 -100.46 118.9 37.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.52 176.272 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 92.4 mtt180 -64.48 -27.34 68.92 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.87 0.367 . . . . 0.0 110.083 179.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -65.21 -41.28 94.63 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.861 172.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -67.7 -45.73 73.62 Favored Glycine 0 C--N 1.331 0.274 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.522 178.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 7.7 tt -54.74 -42.6 71.8 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.166 -0.517 . . . . 0.0 110.003 175.457 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.472 ' O ' ' HG2' ' A' ' 30' ' ' ARG . 19.2 tp10 -58.03 -53.77 54.46 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.267 178.849 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -61.14 -40.2 92.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.262 -178.122 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.448 ' HB2' HD23 ' A' ' 18' ' ' LEU . 80.9 t80 -68.47 -48.7 63.82 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.201 -176.804 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.8 t -61.61 -34.51 75.78 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-O 120.72 0.295 . . . . 0.0 110.339 -177.44 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.472 ' HG2' ' O ' ' A' ' 26' ' ' GLU . 26.5 mmt180 -59.38 -52.0 67.49 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.335 176.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -64.35 -42.23 96.33 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.669 179.054 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 13.7 tp -65.55 -27.62 68.57 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.582 -176.036 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.529 ' HG2' ' HB3' ' A' ' 38' ' ' GLU . 56.9 mttm -75.13 -43.93 49.88 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.082 177.104 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.1 t -71.41 -17.95 62.37 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 120.93 0.395 . . . . 0.0 110.177 177.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -92.09 13.47 18.8 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.632 174.552 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 41.7 p90 46.61 22.75 0.19 Allowed 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.353 1.061 . . . . 0.0 112.87 178.258 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 24.4 m -107.98 18.28 21.42 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.102 0.477 . . . . 0.0 110.153 179.049 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.529 ' HB3' ' HG2' ' A' ' 33' ' ' LYS . 11.6 pt-20 -54.23 -19.88 5.99 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.824 -178.324 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -49.84 -48.02 51.27 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.906 176.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 10.1 m120 -57.42 -61.28 2.6 Favored 'General case' 0 C--O 1.244 0.799 0 CA-C-O 121.133 0.492 . . . . 0.0 111.878 -173.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.547 HG22 ' HG3' ' A' ' 42' ' ' GLU . 7.1 tp -56.3 -46.88 81.78 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.36 -177.467 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.547 ' HG3' HG22 ' A' ' 41' ' ' ILE . 46.9 mt-10 -78.6 -11.82 59.99 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.412 -176.333 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -70.74 -65.89 0.68 Allowed 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 116.561 -0.29 . . . . 0.0 110.32 177.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.487 ' HA ' ' SG ' ' A' ' 47' ' ' CYS . 22.8 p-90 -73.3 -19.51 61.02 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 119.6 -0.84 . . . . 0.0 111.484 -177.003 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 11.0 mt -60.56 -42.6 92.14 Favored 'Isoleucine or valine' 0 C--O 1.236 0.384 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 167.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.8 -28.73 62.75 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.914 178.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.5 ' O ' ' HB3' ' A' ' 50' ' ' PHE . 77.3 m -66.04 -37.06 84.9 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.798 179.233 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -77.93 -26.89 49.2 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.824 177.443 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.759 ' HA ' ' HE3' ' A' ' 52' ' ' LYS . 16.0 t70 -63.78 -39.37 94.08 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.577 0.703 . . . . 0.0 109.235 169.683 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.5 ' HB3' ' O ' ' A' ' 47' ' ' CYS . 91.4 t80 -61.51 -44.56 96.85 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.668 -1.151 . . . . 0.0 109.921 175.043 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.414 ' HA ' ' O ' ' A' ' 98' ' ' LEU . 23.7 ttpp -58.68 -39.22 80.07 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.831 -177.821 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.759 ' HE3' ' HA ' ' A' ' 49' ' ' ASP . 23.2 pttp -83.82 1.59 42.32 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 120.777 0.322 . . . . 0.0 111.647 -176.55 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 14.6 m -103.35 54.35 0.76 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.76 0.79 . . . . 0.0 108.934 175.265 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.93 -4.73 2.34 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.325 -1.307 . . . . 0.0 113.807 -167.511 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -61.24 116.27 9.1 Favored Glycine 0 C--O 1.224 -0.477 0 C-N-CA 120.533 -0.841 . . . . 0.0 111.25 177.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -44.72 -47.53 11.45 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 123.419 2.746 . . . . 0.0 113.133 -173.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . 0.45 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 50.8 mt-30 -63.37 -50.66 69.06 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 121.021 0.439 . . . . 0.0 109.844 178.686 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -55.97 -37.65 69.35 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.599 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.492 HG22 ' CZ ' ' A' ' 50' ' ' PHE . 23.9 mm -57.74 -53.02 50.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.714 178.035 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 14.0 m-70 -63.38 -36.18 82.86 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.748 0.308 . . . . 0.0 110.682 -178.061 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' ' 57' ' ' GLN . 88.5 mt -64.92 -50.56 66.0 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.931 -179.72 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -69.89 -36.47 75.45 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.872 -178.236 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.76 -48.24 82.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.674 179.553 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 20.3 tptp -68.38 -29.75 68.52 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.192 -179.266 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -65.81 -61.35 2.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.076 175.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 71.2 mt -55.2 -32.99 29.26 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.168 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.581 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.456 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 77.2 t80 -54.77 -66.16 0.45 Allowed 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.535 177.789 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -76.88 -12.34 59.95 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.911 -174.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 54.3 tptt -92.82 -32.84 14.49 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.247 -177.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . 0.41 ' HB3' ' CG2' ' A' ' 79' ' ' VAL . 80.5 m-85 -133.49 -49.32 0.84 Allowed 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -172.934 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.456 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 49.8 mm -67.53 -28.25 41.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 CA-C-O 121.096 0.475 . . . . 0.0 111.071 -171.486 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.53 ' HB3' ' HB2' ' A' ' 75' ' ' ALA . 0.0 OUTLIER -65.49 125.9 26.62 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.493 178.677 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 25.0 m -58.38 -30.03 66.48 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 121.27 0.557 . . . . 0.0 110.426 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 42.1 m-20 -109.42 94.02 4.82 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 170.675 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.53 ' HB2' ' HB3' ' A' ' 72' ' ' GLN . . . -152.37 164.89 18.84 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 115.439 -0.801 . . . . 0.0 109.832 -176.244 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -46.77 -45.35 20.44 Favored 'Trans proline' 0 C--N 1.357 0.974 0 C-N-CA 122.643 2.228 . . . . 0.0 112.299 178.556 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -130.51 89.96 2.85 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 173.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.412 ' O ' ' HG2' ' A' ' 78' ' ' GLU . 0.6 OUTLIER -68.6 117.19 10.02 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.437 -179.12 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.41 ' CG2' ' HB3' ' A' ' 70' ' ' PHE . 97.3 t -69.31 138.81 21.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.615 178.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -79.45 30.72 0.23 Allowed 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.151 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.428 HD13 HG23 ' A' ' 85' ' ' THR . 39.4 tp -75.06 146.03 41.84 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.706 -175.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -53.04 145.94 12.12 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.26 -0.882 . . . . 0.0 112.052 178.569 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 39.9 p90 -66.71 -38.97 87.79 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.38 -176.336 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 79.8 t60 -69.42 -35.02 75.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.842 0.353 . . . . 0.0 110.361 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.428 HG23 HD13 ' A' ' 81' ' ' LEU . 21.4 m -70.34 -45.77 65.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.739 -179.56 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.475 ' O ' HG23 ' A' ' 90' ' ' THR . 19.3 ptpt -64.64 -31.12 72.2 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 178.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -58.73 -47.49 84.43 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.197 176.305 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 65.0 t -58.74 -43.08 87.04 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 CA-C-O 121.036 0.446 . . . . 0.0 110.284 177.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 65.0 mt -61.69 -46.9 95.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.17 -179.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.475 HG23 ' O ' ' A' ' 86' ' ' LYS . 78.8 p -60.26 -42.77 96.03 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.099 0.476 . . . . 0.0 110.864 -177.443 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -83.75 -7.01 59.57 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.96 -0.564 . . . . 0.0 112.143 -176.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 23.7 m -124.03 6.15 8.6 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 11.1 tp -67.25 -21.39 27.89 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 CA-C-O 120.999 0.428 . . . . 0.0 110.464 -178.031 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 9.9 t -58.73 -36.87 75.0 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.169 178.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -141.46 83.95 12.92 Favored Pre-proline 0 C--O 1.233 0.197 0 CA-C-O 120.953 0.406 . . . . 0.0 110.23 -179.379 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . 0.437 ' HG2' HG23 ' A' ' 59' ' ' ILE . 86.2 Cg_endo -81.55 156.56 18.87 Favored 'Trans proline' 0 CA--C 1.532 0.411 0 C-N-CA 122.714 2.276 . . . . 0.0 112.298 178.771 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' THR . . . . . 0.4 ' H ' ' HB2' ' A' ' 100' ' ' SER . 62.8 p -86.78 -171.82 3.71 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.575 176.594 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . 0.414 ' O ' ' HA ' ' A' ' 51' ' ' LYS . 34.8 tp -51.04 -37.43 45.35 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.189 0.519 . . . . 0.0 110.847 -177.621 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -152.29 76.84 1.18 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.586 0.708 . . . . 0.0 109.537 170.803 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' SER . . . . . 0.4 ' HB2' ' H ' ' A' ' 97' ' ' THR . 13.1 t -58.83 -19.33 40.42 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 115.172 -0.922 . . . . 0.0 111.485 -176.346 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 75.9 m-85 -77.31 6.22 7.19 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.868 -179.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -52.16 -50.86 60.95 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 122.966 0.506 . . . . 0.0 111.034 177.631 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.4 ' O ' ' HD3' ' A' ' 107' ' ' ARG . . . -61.05 -42.58 98.75 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.535 179.253 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.19 -43.25 99.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.616 179.033 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 25.4 tt0 -54.53 -44.44 72.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.373 177.786 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' SER . . . . . 0.443 ' O ' ' HG2' ' A' ' 110' ' ' GLN . 32.1 m -56.96 -47.47 80.62 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.512 179.712 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . 0.444 ' O ' ' HG ' ' A' ' 111' ' ' LEU . 12.5 mpt_? -62.9 -63.93 1.06 Allowed 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.548 178.602 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.472 ' O ' ' HG3' ' A' ' 112' ' ' MET . 80.2 t -50.82 -42.45 23.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.435 -175.0 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . 0.587 ' HA ' ' HE1' ' A' ' 112' ' ' MET . 32.5 t80 -56.99 -59.53 4.92 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.119 179.159 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . 0.443 ' HG2' ' O ' ' A' ' 106' ' ' SER . 4.1 pt20 -71.26 -20.56 62.21 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 120.553 0.216 . . . . 0.0 111.455 -174.854 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 107' ' ' ARG . 76.3 mt -69.65 -41.11 76.0 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.805 -0.18 . . . . 0.0 111.006 178.76 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' MET . . . . . 0.587 ' HE1' ' HA ' ' A' ' 109' ' ' TYR . 0.0 OUTLIER -91.55 -12.02 35.63 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 120.955 -0.298 . . . . 0.0 110.79 178.932 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . 0.494 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 42.5 tt0 -68.05 -56.71 7.88 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 171.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -58.28 -22.88 54.35 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.226 -176.157 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -110.91 -69.28 0.88 Allowed 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 120.976 0.417 . . . . 0.0 111.089 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' SER . . . . . 0.442 ' HA ' ' HB3' ' A' ' 119' ' ' ARG . 22.1 m -69.58 -17.92 63.59 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 -168.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . 0.494 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 22.5 t80 -68.46 -60.44 2.43 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 118.116 0.417 . . . . 0.0 110.431 177.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 20.6 p -65.12 -34.47 78.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.314 0.578 . . . . 0.0 110.272 178.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . 0.442 ' HB3' ' HA ' ' A' ' 116' ' ' SER . 16.3 ttt180 -55.29 -46.8 76.2 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 114.953 -1.021 . . . . 0.0 109.472 173.313 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -65.62 -41.5 92.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.346 177.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 90.5 mt -58.21 -25.57 61.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.633 0.254 . . . . 0.0 111.21 -179.452 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 11.4 mptt -113.65 7.96 17.44 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 179.083 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 78.4 p -69.41 140.77 54.17 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 171.289 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -54.43 -33.49 59.58 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 111.522 0.193 . . . . 0.0 111.522 -179.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 9.9 tp -66.31 -40.81 87.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 CA-C-O 120.743 0.306 . . . . 0.0 110.878 -178.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' TYR . . . . . 0.521 ' O ' ' HG2' ' A' ' 130' ' ' MET . 84.7 t80 -72.17 -43.24 64.89 Favored 'General case' 0 C--O 1.232 0.176 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 176.349 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 91.4 mt -61.86 -23.79 66.5 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.199 177.351 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -68.58 -43.56 76.26 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.133 173.094 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 80.9 mt -61.65 -29.4 70.04 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.242 176.338 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' MET . . . . . 0.78 ' SD ' HG11 ' A' ' 9' ' ' VAL . 19.4 mmt . . . . . 0 C--O 1.235 0.315 0 CA-C-O 121.632 0.73 . . . . 0.0 110.498 -179.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 3.2 p . . . . . 0 C--O 1.233 0.224 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 17.6 m -62.13 136.24 95.28 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.109 179.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.432 ' O ' HG12 ' A' ' 9' ' ' VAL . 8.2 Cg_endo -49.72 -26.77 13.81 Favored 'Trans proline' 0 C--N 1.355 0.872 0 C-N-CA 123.186 2.591 . . . . 0.0 112.464 -178.149 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.577 ' O ' ' HG2' ' A' ' 10' ' ' LYS . 32.8 tt0 -58.53 -58.06 10.2 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.16 176.168 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -59.25 -37.1 76.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.252 0.548 . . . . 0.0 110.187 175.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.5 -39.75 94.5 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.663 -177.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.554 HG21 ' O ' ' A' ' 6' ' ' GLU . 27.0 m -72.1 -26.58 25.3 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.297 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.261 178.011 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.577 ' HG2' ' O ' ' A' ' 6' ' ' GLU . 14.4 mmmm -63.31 -38.15 90.03 Favored 'General case' 0 N--CA 1.463 0.207 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 174.702 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 54.0 m0 -61.33 -29.65 70.02 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.634 176.168 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -74.42 6.96 20.49 Favored Glycine 0 CA--C 1.521 0.443 0 CA-C-N 115.64 -0.709 . . . . 0.0 113.719 -176.308 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.497 ' HG3' ' O ' ' A' ' 10' ' ' LYS . 0.0 OUTLIER -132.49 12.0 4.5 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 117.475 0.638 . . . . 0.0 111.244 176.391 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.432 ' HB3' ' HG2' ' A' ' 17' ' ' LYS . 44.2 t -171.0 100.59 0.21 Allowed 'General case' 0 C--O 1.237 0.444 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.169 176.863 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.414 ' HD1' HD22 ' A' ' 18' ' ' LEU . 37.0 t80 -55.12 -29.02 56.82 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.36 176.418 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -57.59 -52.06 66.94 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.994 -179.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.432 ' HG2' ' HB3' ' A' ' 14' ' ' SER . 17.7 ptpt -74.42 -28.39 61.05 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 120.946 -0.302 . . . . 0.0 110.533 -174.837 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.414 HD22 ' HD1' ' A' ' 15' ' ' PHE . 16.4 tp -57.19 -51.36 69.62 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.018 173.893 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.531 HD12 ' HA ' ' A' ' 25' ' ' LEU . 15.7 tp -82.9 -22.54 33.9 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.821 -175.508 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 23.2 t -76.71 -25.73 53.91 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.278 178.21 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -73.59 120.87 19.79 Favored 'General case' 0 C--O 1.222 -0.347 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 177.911 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.433 ' O ' ' HB3' ' A' ' 25' ' ' LEU . 60.9 mtp180 -43.06 -56.65 3.25 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.226 0.61 . . . . 0.0 112.551 -173.718 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -72.56 -26.52 61.76 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.816 0.341 . . . . 0.0 110.469 -178.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -68.17 -34.55 81.18 Favored Glycine 0 C--N 1.333 0.397 0 N-CA-C 111.384 -0.686 . . . . 0.0 111.384 176.325 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.531 ' HA ' HD12 ' A' ' 19' ' ' LEU . 9.3 tp -58.31 -54.72 43.83 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.536 0.684 . . . . 0.0 109.505 174.423 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.468 ' O ' ' HG2' ' A' ' 30' ' ' ARG . 8.8 tp10 -61.59 -34.58 75.86 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 114.715 -1.13 . . . . 0.0 110.459 -179.408 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.538 ' O ' ' HB2' ' A' ' 30' ' ' ARG . . . -68.28 -52.25 35.87 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 121.053 0.454 . . . . 0.0 111.153 179.323 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -64.75 -39.54 93.8 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.656 -177.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.532 ' OG1' ' HE2' ' A' ' 33' ' ' LYS . 3.6 t -64.31 -33.25 75.4 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 -179.482 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.538 ' HB2' ' O ' ' A' ' 27' ' ' ALA . 67.1 mmt-85 -52.43 -51.2 60.4 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.295 0.569 . . . . 0.0 109.556 171.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.463 ' O ' HG23 ' A' ' 34' ' ' THR . 69.2 t80 -64.56 -46.81 81.19 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 114.991 -1.004 . . . . 0.0 110.864 -178.158 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.516 HD22 ' HB2' ' A' ' 40' ' ' ASN . 23.1 tp -70.48 -23.23 62.64 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.418 -175.583 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.566 ' HZ1' ' HG3' ' A' ' 38' ' ' GLU . 68.4 mttm -86.1 -34.15 20.73 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.771 -0.195 . . . . 0.0 110.964 178.53 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.463 HG23 ' O ' ' A' ' 31' ' ' PHE . 14.3 t -72.37 -22.94 61.07 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 121.08 -0.248 . . . . 0.0 110.854 -178.202 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.418 ' CD ' HH12 ' A' ' 119' ' ' ARG . 12.6 pt-20 -88.27 5.04 43.66 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 120.978 0.418 . . . . 0.0 110.028 174.088 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 33.0 t80 68.7 26.93 6.05 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.63 174.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 50.1 m -91.96 -78.52 0.4 Allowed 'General case' 0 CA--C 1.532 0.264 0 O-C-N 122.06 -0.4 . . . . 0.0 110.016 176.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.566 ' HG3' ' HZ1' ' A' ' 33' ' ' LYS . 32.8 tt0 67.37 -64.61 0.25 Allowed 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 112.959 0.726 . . . . 0.0 112.959 175.667 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -39.32 -38.95 0.58 Allowed 'General case' 0 C--O 1.22 -0.484 0 C-N-CA 123.899 0.88 . . . . 0.0 113.061 -174.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . 0.516 ' HB2' HD22 ' A' ' 32' ' ' LEU . 43.2 m-80 -50.43 -68.89 0.13 Allowed 'General case' 0 C--O 1.242 0.665 0 CA-C-O 121.062 0.458 . . . . 0.0 111.879 -176.668 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.433 HD13 HD13 ' A' ' 19' ' ' LEU . 3.7 tt -61.95 -44.33 98.76 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.857 -176.346 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -62.89 -31.59 72.68 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.081 -179.053 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 66.2 t80 -65.29 -66.71 0.51 Allowed 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.353 -177.209 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.506 ' HE1' ' HE3' ' A' ' 112' ' ' MET . 33.6 p-90 -71.23 -23.97 62.1 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 119.707 -0.797 . . . . 0.0 111.805 -171.957 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 14.7 tt -66.85 -36.26 76.75 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 C-N-CA 120.213 -0.595 . . . . 0.0 109.592 177.1 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.0 -33.09 75.02 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 121.26 0.552 . . . . 0.0 109.887 173.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 72.5 m -70.4 -29.16 65.72 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.364 177.131 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.556 ' O ' ' HG3' ' A' ' 52' ' ' LYS . 37.0 mm-40 -72.93 -30.86 64.22 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 116.671 -0.24 . . . . 0.0 110.517 177.162 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.794 ' HA ' ' HE3' ' A' ' 52' ' ' LYS . 30.3 t70 -61.08 -42.18 98.03 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 172.126 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -63.46 -35.81 81.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.048 174.092 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.521 ' HB2' ' HA ' ' A' ' 48' ' ' GLU . 1.1 tppp? -59.28 -29.45 67.6 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.964 178.136 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.794 ' HE3' ' HA ' ' A' ' 49' ' ' ASP . 9.4 mtmp? -87.46 -19.6 27.77 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.104 -179.03 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 18.8 m -73.36 82.09 1.4 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.343 0.592 . . . . 0.0 111.102 -173.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.442 ' HD3' ' O ' ' A' ' 54' ' ' LYS . 0.0 OUTLIER -76.02 103.85 6.27 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.84 178.326 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . 0.515 ' O ' HG12 ' A' ' 59' ' ' ILE . . . 173.1 119.84 0.54 Allowed Glycine 0 N--CA 1.45 -0.406 0 N-CA-C 110.93 -0.868 . . . . 0.0 110.93 178.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_endo -55.35 -46.77 30.04 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.74 2.293 . . . . 0.0 112.348 -174.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . 0.421 ' NE2' HE21 ' A' ' 58' ' ' GLN . 7.9 pm0 -67.75 -34.46 76.86 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.192 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.421 HE21 ' NE2' ' A' ' 57' ' ' GLN . 66.5 mm-40 -63.38 -40.76 98.11 Favored 'General case' 0 N--CA 1.462 0.14 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 179.149 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.515 HG12 ' O ' ' A' ' 55' ' ' GLY . 47.3 mm -54.51 -42.03 57.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.907 -179.663 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 32.5 m-70 -67.57 -56.1 10.78 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.194 -178.161 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.467 HD12 ' N ' ' A' ' 62' ' ' LYS . 3.9 pp -73.2 -34.46 65.98 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 112.534 0.568 . . . . 0.0 112.534 -171.191 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.467 ' N ' HD12 ' A' ' 61' ' ' LEU . 47.1 mtpt -75.95 -40.72 53.41 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 120.869 -0.333 . . . . 0.0 110.675 179.506 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.15 -41.71 97.07 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.879 0.371 . . . . 0.0 110.228 177.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 15.9 tppt? -60.39 -41.51 93.97 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.855 177.314 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.26 -49.4 77.22 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.934 179.159 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 68.8 mt -64.95 -35.76 76.16 Favored 'Isoleucine or valine' 0 C--O 1.234 0.273 0 CA-C-O 121.229 0.538 . . . . 0.0 110.35 178.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 74.0 t80 -57.88 -63.14 1.35 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.875 -179.078 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -68.96 -29.27 67.46 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.914 -173.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 64.9 tttm -94.93 -17.22 22.19 Favored 'General case' 0 C--O 1.237 0.423 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -172.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 99.2 m-85 -133.29 -52.16 0.89 Allowed 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 112.311 0.485 . . . . 0.0 112.311 -177.185 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 50.3 mm -67.03 -44.11 88.53 Favored 'Isoleucine or valine' 0 C--O 1.238 0.45 0 CA-C-O 120.886 0.374 . . . . 0.0 111.417 -172.048 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.422 ' HG3' ' H ' ' A' ' 74' ' ' ASP . 6.3 tp-100 -72.12 145.17 48.32 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.889 -174.624 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.406 ' O ' HG23 ' A' ' 73' ' ' THR . 13.2 m -85.78 27.45 0.86 Allowed 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 121.952 0.882 . . . . 0.0 110.36 178.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . 0.422 ' H ' ' HG3' ' A' ' 72' ' ' GLN . 13.9 m-20 -128.83 20.96 5.94 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 174.018 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -86.33 159.38 53.49 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 114.988 -1.006 . . . . 0.0 111.837 -171.139 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_endo -85.65 11.63 3.29 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.964 2.443 . . . . 0.0 111.973 177.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.644 ' HA ' ' HE2' ' A' ' 77' ' ' LYS . 0.4 OUTLIER -128.57 -44.41 1.37 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.242 178.394 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 64.52 97.63 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.581 178.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 58.2 t -101.3 134.18 42.33 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.271 177.163 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 38.5 m-80 -83.48 27.32 0.61 Allowed 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.538 -176.182 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 9.4 tp -57.45 143.28 41.02 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.552 174.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -46.69 128.64 10.8 Favored 'General case' 0 C--O 1.237 0.446 0 O-C-N 123.892 0.745 . . . . 0.0 111.7 -175.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -59.22 -45.75 90.28 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.196 -175.046 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . 0.466 ' O ' ' HB3' ' A' ' 87' ' ' GLU . 54.0 t60 -61.15 -29.63 69.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.898 179.662 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 28.2 m -71.34 -49.41 42.74 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.746 179.075 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.517 ' O ' HG23 ' A' ' 90' ' ' THR . 17.8 ptpt -66.95 -23.22 65.93 Favored 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 120.816 -0.353 . . . . 0.0 110.081 179.769 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.466 ' HB3' ' O ' ' A' ' 84' ' ' HIS . 41.1 tt0 -58.29 -53.09 62.19 Favored 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 171.196 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 58.5 t -58.88 -41.22 82.28 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.335 176.556 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 69.3 mt -60.41 -43.94 95.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.233 -179.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.517 HG23 ' O ' ' A' ' 86' ' ' LYS . 76.4 p -61.9 -31.68 72.0 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.214 0.53 . . . . 0.0 110.147 178.904 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . 0.473 ' N ' HD21 ' A' ' 91' ' ' ASN . 0.9 OUTLIER -79.95 -16.94 54.23 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.209 179.165 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 20.3 m -108.79 -14.24 14.63 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -176.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.0 tp -64.49 -21.61 29.51 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -170.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 7.7 t -57.01 -44.99 83.34 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 120.999 0.428 . . . . 0.0 110.368 177.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 -149.64 80.77 7.41 Favored Pre-proline 0 C--O 1.238 0.47 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 178.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . 0.505 ' HG2' HG23 ' A' ' 59' ' ' ILE . 74.1 Cg_endo -75.42 -161.67 0.13 Allowed 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 123.058 2.505 . . . . 0.0 112.591 -176.368 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 9.4 m -152.49 165.73 34.18 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.671 -176.198 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -47.32 -60.72 2.31 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 122.644 0.378 . . . . 0.0 111.489 -177.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' HIS . . . . . 0.459 ' ND1' ' HD2' ' A' ' 51' ' ' LYS . 77.0 m-70 -95.32 24.54 4.98 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.548 -0.297 . . . . 0.0 111.51 -177.085 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 41.4 t -66.24 -40.15 90.05 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.268 0.556 . . . . 0.0 109.724 176.356 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 81.7 m-85 -88.02 6.91 33.75 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.911 179.1 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . 0.501 ' O ' ' HB3' ' A' ' 105' ' ' GLN . 9.5 t70 -70.54 -33.88 71.64 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 178.255 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.574 ' O ' ' HG2' ' A' ' 107' ' ' ARG . . . -61.99 -42.51 99.23 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.629 173.561 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.05 -41.03 86.9 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.064 176.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.501 ' HB3' ' O ' ' A' ' 102' ' ' ASP . 25.4 tt0 -53.24 -53.94 43.43 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.954 174.232 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 42.7 t -51.72 -44.98 63.41 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.253 -177.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . 0.574 ' HG2' ' O ' ' A' ' 103' ' ' ALA . 19.9 mmm180 -62.8 -50.72 69.88 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 120.937 0.398 . . . . 0.0 111.076 -175.49 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 90.7 t -71.52 -42.76 72.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.925 -177.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 59.8 t80 -58.12 -53.21 60.8 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.525 179.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . 0.533 ' O ' ' HG2' ' A' ' 114' ' ' GLN . 0.0 OUTLIER -64.98 -32.05 73.59 Favored 'General case' 0 N--CA 1.461 0.091 0 N-CA-C 110.159 -0.312 . . . . 0.0 110.159 -178.994 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 58.2 tp -62.14 -62.32 1.86 Allowed 'General case' 0 N--CA 1.46 0.053 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.549 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' MET . . . . . 0.506 ' HE3' ' HE1' ' A' ' 44' ' ' TRP . 25.4 ptt? -67.72 -21.55 65.29 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-O 120.747 0.308 . . . . 0.0 110.43 -178.443 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . 0.523 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 42.6 tt0 -64.22 -55.55 20.79 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 174.723 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . 0.533 ' HG2' ' O ' ' A' ' 110' ' ' GLN . 12.6 pt20 -77.5 -18.43 57.08 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.774 -177.046 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -114.96 3.9 14.64 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 -175.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' SER . . . . . 0.461 ' HB3' ' O ' ' A' ' 112' ' ' MET . 32.2 t -147.03 -43.53 0.18 Allowed 'General case' 0 N--CA 1.466 0.339 0 O-C-N 122.068 -0.395 . . . . 0.0 111.442 177.726 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . 0.523 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 32.4 t80 -65.93 -40.3 91.29 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 120.913 0.387 . . . . 0.0 110.579 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 29.9 p -56.73 -55.01 39.67 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-O 121.665 0.745 . . . . 0.0 110.035 174.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . 0.418 HH12 ' CD ' ' A' ' 35' ' ' GLU . 27.1 mtp180 -58.2 -35.34 71.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 114.881 -1.054 . . . . 0.0 110.863 176.558 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 79.4 t80 -60.71 -45.3 94.77 Favored 'General case' 0 C--O 1.224 -0.282 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 179.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 87.4 mt -63.67 -23.58 67.43 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.954 0.407 . . . . 0.0 110.471 177.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -101.43 0.77 37.44 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.17 -0.468 . . . . 0.0 112.255 179.054 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 76.6 p -76.58 147.08 37.89 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 120.627 0.251 . . . . 0.0 110.513 -176.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -58.21 -31.17 67.08 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 175.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 43.7 mm -56.69 -48.94 79.99 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 CA-C-N 115.144 -0.935 . . . . 0.0 110.631 175.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' TYR . . . . . 0.411 ' O ' ' HG2' ' A' ' 130' ' ' MET . 88.4 t80 -66.43 -43.66 85.04 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.572 -179.252 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -62.14 -34.12 75.76 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.408 178.114 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -64.36 -35.24 80.25 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.061 175.023 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 99.6 mt -76.53 -25.69 54.41 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.84 177.328 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' MET . . . . . 0.741 ' HA ' ' HE3' ' A' ' 130' ' ' MET . 12.7 mmt . . . . . 0 N--CA 1.464 0.269 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.338 178.254 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . 0.506 HG23 ' CZ2' ' A' ' 11' ' ' TRP . 8.9 p . . . . . 0 CA--C 1.534 0.328 0 CA-C-O 120.926 0.393 . . . . 0.0 111.264 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.4 m -91.9 148.81 37.79 Favored Pre-proline 0 CA--C 1.534 0.362 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.059 177.067 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -50.38 -36.49 48.19 Favored 'Trans proline' 0 C--N 1.353 0.768 0 C-N-CA 123.078 2.518 . . . . 0.0 113.007 -176.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.54 ' O ' HG21 ' A' ' 9' ' ' VAL . 1.0 OUTLIER -65.65 -41.07 92.99 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 121.473 0.654 . . . . 0.0 110.029 179.844 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.515 ' O ' ' HB2' ' A' ' 10' ' ' LYS . 2.6 tm-20 -69.64 -30.27 67.93 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 178.283 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.83 -44.54 80.86 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.067 178.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.648 HG13 ' SD ' ' A' ' 130' ' ' MET . 17.5 m -66.3 -26.07 37.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 CA-C-O 120.942 0.401 . . . . 0.0 110.39 179.495 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.53 ' O ' ' HG2' ' A' ' 13' ' ' GLU . 41.5 mmtm -57.89 -34.56 69.93 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.984 175.038 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . 0.506 ' CZ2' HG23 ' A' ' 3' ' ' VAL . 43.1 m0 -60.08 -32.43 70.95 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 120.871 0.367 . . . . 0.0 110.946 -179.142 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -65.19 -3.15 10.88 Favored Glycine 0 CA--C 1.521 0.448 0 CA-C-N 115.667 -0.697 . . . . 0.0 114.477 -171.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.53 ' HG2' ' O ' ' A' ' 10' ' ' LYS . 13.4 pt-20 -91.35 -32.52 15.65 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 117.68 0.74 . . . . 0.0 110.897 179.406 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 51.8 m -150.37 123.58 8.89 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.022 -174.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.482 ' HZ ' ' SD ' ' A' ' 112' ' ' MET . 17.9 t80 -58.92 -32.48 69.6 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.984 176.55 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -54.46 -43.73 71.94 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.904 175.253 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -67.59 -42.58 82.26 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.343 179.103 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 68.2 tp -54.44 -38.98 66.93 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.17 177.199 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 53.1 tp -75.11 -28.4 60.21 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.027 179.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 38.4 m -68.23 -36.18 79.1 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.258 -177.396 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -86.77 121.5 29.36 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 179.748 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.6 ptm180 -58.08 -28.21 64.36 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.118 0.485 . . . . 0.0 110.292 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -61.75 -49.6 75.76 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.36 174.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -63.68 -44.67 96.04 Favored Glycine 0 C--N 1.335 0.492 0 CA-C-N 115.018 -0.992 . . . . 0.0 111.778 179.447 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 15.3 tp -48.7 -60.39 2.76 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 123.018 0.527 . . . . 0.0 111.072 177.314 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.467 ' O ' ' HB2' ' A' ' 30' ' ' ARG . 11.1 tp10 -59.01 -50.01 75.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.874 -175.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -60.68 -35.13 75.51 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 121.053 0.454 . . . . 0.0 111.106 -179.084 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 91.9 t80 -75.08 -46.3 35.59 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.861 -176.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.584 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 11.9 t -70.75 -27.8 64.22 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 -176.164 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.467 ' HB2' ' O ' ' A' ' 26' ' ' GLU . 0.2 OUTLIER -61.83 -54.73 38.14 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.191 -0.913 . . . . 0.0 109.863 177.714 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.489 ' O ' ' HB ' ' A' ' 34' ' ' THR . 86.9 t80 -57.62 -34.06 68.9 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.178 0.513 . . . . 0.0 110.653 -179.087 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 26.7 tp -74.81 -45.99 39.81 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.947 -178.242 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.584 ' HG3' ' O ' ' A' ' 29' ' ' THR . 68.3 mttm -60.95 -25.4 66.79 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.232 0.539 . . . . 0.0 110.002 177.211 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.489 ' HB ' ' O ' ' A' ' 31' ' ' PHE . 96.4 m -60.77 -35.31 76.09 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.263 177.691 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -101.89 9.78 40.34 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 120.986 0.422 . . . . 0.0 110.481 176.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 83.6 m-85 66.23 8.26 5.45 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.478 -0.783 . . . . 0.0 112.572 173.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 21.4 t -92.81 43.33 1.12 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.191 0.52 . . . . 0.0 109.751 -178.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -86.4 2.03 49.11 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.746 -174.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.35 -31.57 72.83 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -175.935 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . 0.614 ' OD1' ' HE1' ' A' ' 112' ' ' MET . 6.2 p30 -69.25 -57.99 4.63 Favored 'General case' 0 C--O 1.246 0.88 0 N-CA-C 111.969 0.359 . . . . 0.0 111.969 -176.38 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.421 ' O ' HG13 ' A' ' 45' ' ' ILE . 13.8 tt -63.0 -46.81 95.36 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-O 120.574 0.226 . . . . 0.0 110.477 -177.184 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -62.99 -24.5 67.94 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.066 177.681 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.454 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 82.9 t80 -62.75 -63.2 1.28 Allowed 'General case' 0 C--O 1.235 0.312 0 C-N-CA 121.399 -0.121 . . . . 0.0 111.022 179.552 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.599 ' HE1' ' HE2' ' A' ' 112' ' ' MET . 20.9 p-90 -70.97 -19.86 62.5 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 119.439 -0.904 . . . . 0.0 111.468 -175.146 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.421 HG13 ' O ' ' A' ' 41' ' ' ILE . 66.3 mt -67.33 -51.05 56.84 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 CA-C-O 121.293 0.568 . . . . 0.0 109.786 170.846 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.39 -28.6 69.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.514 178.693 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.608 ' SG ' ' HB2' ' A' ' 101' ' ' PHE . 41.0 t -68.58 -33.43 74.05 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.583 -179.722 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.709 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 10.5 pt-20 -83.29 -25.69 31.33 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 120.444 -0.503 . . . . 0.0 110.318 176.661 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.474 ' HA ' ' HE3' ' A' ' 52' ' ' LYS . 18.1 t70 -62.57 -33.37 74.82 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 168.81 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -71.62 -56.12 6.45 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 114.632 -1.167 . . . . 0.0 111.121 174.599 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.709 ' HG2' ' HA ' ' A' ' 48' ' ' GLU . 25.4 pttm -85.03 11.49 9.47 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -171.4 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.474 ' HE3' ' HA ' ' A' ' 49' ' ' ASP . 18.5 ptpt -88.67 -24.19 22.82 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 168.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 17.3 p -90.25 122.03 32.81 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 174.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -100.13 6.16 44.89 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.623 -172.259 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . 0.438 ' O ' HG12 ' A' ' 59' ' ' ILE . . . -67.09 123.03 20.59 Favored Glycine 0 CA--C 1.519 0.309 0 C-N-CA 121.015 -0.612 . . . . 0.0 112.013 179.187 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . 0.467 ' O ' ' HD2' ' A' ' 60' ' ' HIS . 12.2 Cg_endo -54.05 -46.91 30.12 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.671 2.248 . . . . 0.0 112.067 -177.922 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 82.0 mm-40 -64.29 -40.52 96.13 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 121.346 0.593 . . . . 0.0 109.845 178.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.444 ' OE1' HD12 ' A' ' 61' ' ' LEU . 6.5 tp-100 -58.66 -43.29 89.82 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 114.829 -1.078 . . . . 0.0 110.557 -179.116 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.438 HG12 ' O ' ' A' ' 55' ' ' GLY . 42.3 mm -57.29 -49.5 79.75 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.212 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.809 -178.055 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.467 ' HD2' ' O ' ' A' ' 56' ' ' PRO . 74.8 m-70 -64.45 -54.3 34.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.596 -0.275 . . . . 0.0 111.563 -173.933 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.504 HD11 ' N ' ' A' ' 62' ' ' LYS . 4.2 pp -64.48 -31.83 73.21 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.624 0.249 . . . . 0.0 111.648 -175.88 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.504 ' N ' HD11 ' A' ' 61' ' ' LEU . 36.3 mmtm -71.49 -53.16 14.82 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 120.629 0.252 . . . . 0.0 110.544 176.414 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.69 -38.08 74.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.885 -178.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 27.6 tptp -65.49 -41.26 93.46 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.232 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -64.84 -50.81 65.21 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.687 178.463 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 70.6 mt -58.58 -36.56 60.26 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.206 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.198 178.42 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.443 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 91.6 t80 -56.01 -63.65 1.11 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.674 178.327 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -64.4 -35.34 80.6 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.752 -0.658 . . . . 0.0 112.04 -174.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 80.9 tttt -90.32 -25.84 20.29 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -170.195 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -127.15 -48.36 1.46 Allowed 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -174.272 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.443 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 48.4 mm -70.56 -38.37 73.24 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 CA-C-O 120.947 0.403 . . . . 0.0 111.19 -173.396 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.492 ' HB3' ' HB2' ' A' ' 75' ' ' ALA . 6.2 tp-100 -61.04 141.37 57.44 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.106 -176.402 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 28.8 m -73.59 -35.06 65.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.237 0.541 . . . . 0.0 110.73 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -93.68 27.66 2.6 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.206 0.527 . . . . 0.0 110.501 175.098 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.492 ' HB2' ' HB3' ' A' ' 72' ' ' GLN . . . -70.93 160.64 81.67 Favored Pre-proline 0 C--O 1.235 0.341 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.49 176.489 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.49 ' HD2' ' HB3' ' A' ' 75' ' ' ALA . 12.2 Cg_endo -55.1 -35.03 89.58 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.799 2.332 . . . . 0.0 112.268 -179.097 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.42 ' O ' ' HB3' ' A' ' 78' ' ' GLU . 33.6 mtmm -122.95 -50.27 1.94 Allowed 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.826 176.895 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.42 ' HB3' ' O ' ' A' ' 77' ' ' LYS . 44.0 tt0 68.9 139.81 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.375 0 O-C-N 123.698 0.623 . . . . 0.0 110.803 -175.132 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.44 ' C ' ' H ' ' A' ' 81' ' ' LEU . 60.8 t -95.44 149.15 4.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.427 175.495 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 41.8 m-80 -70.68 17.24 0.07 Allowed 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 -177.642 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.562 HD11 HG21 ' A' ' 85' ' ' THR . 47.4 tp -60.97 144.07 53.96 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 122.746 0.418 . . . . 0.0 110.822 176.647 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -54.92 143.38 26.33 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.744 -177.054 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.43 ' HA ' ' HG2' ' A' ' 86' ' ' LYS . 89.9 t80 -62.23 -44.7 95.96 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.872 -178.673 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . 0.407 ' O ' HG22 ' A' ' 88' ' ' VAL . 82.0 t60 -66.87 -30.31 70.44 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.567 0.222 . . . . 0.0 110.749 -178.915 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.562 HG21 HD11 ' A' ' 81' ' ' LEU . 27.1 m -69.29 -48.18 62.37 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 177.84 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.499 ' O ' HG22 ' A' ' 90' ' ' THR . 19.0 ptpt -65.97 -28.36 68.84 Favored 'General case' 0 N--CA 1.462 0.129 0 N-CA-C 109.754 -0.462 . . . . 0.0 109.754 178.011 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -60.18 -49.31 78.12 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.148 177.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.407 HG22 ' O ' ' A' ' 84' ' ' HIS . 58.3 t -56.4 -40.82 69.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 121.253 0.549 . . . . 0.0 109.678 176.209 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 72.3 mt -63.9 -42.62 96.41 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.968 178.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.499 HG22 ' O ' ' A' ' 86' ' ' LYS . 67.9 p -62.61 -25.35 68.05 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.891 0.377 . . . . 0.0 110.9 -178.126 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 57.4 m-80 -90.59 -23.74 20.76 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.252 178.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 31.1 t -98.22 -9.64 25.31 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.63 -176.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 9.4 tp -60.89 -26.14 37.81 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 N-CA-C 112.003 0.371 . . . . 0.0 112.003 -174.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 12.3 t -68.57 -24.41 64.6 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 120.83 0.348 . . . . 0.0 110.791 -179.191 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -144.68 76.05 14.34 Favored Pre-proline 0 CA--C 1.532 0.268 0 CA-C-N 116.213 -0.448 . . . . 0.0 109.907 179.466 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -82.3 153.22 16.12 Favored 'Trans proline' 0 C--O 1.237 0.45 0 C-N-CA 122.671 2.247 . . . . 0.0 112.484 -178.118 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 47.8 p -111.3 174.09 6.03 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.228 176.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 34.7 tp -57.78 -57.27 13.49 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.371 0.605 . . . . 0.0 111.111 -178.297 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' HIS . . . . . 0.439 ' HD1' ' HB3' ' A' ' 102' ' ' ASP . 1.2 t-80 -95.85 12.65 29.42 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.326 -171.861 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 22.7 p -44.26 -47.42 9.4 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -172.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.608 ' HB2' ' SG ' ' A' ' 47' ' ' CYS . 99.0 m-85 -78.85 11.61 2.56 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.244 0.831 . . . . 0.0 113.244 -171.892 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . 0.44 ' HA ' ' HG2' ' A' ' 105' ' ' GLN . 8.6 p30 -60.47 -38.68 85.03 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 118.189 0.45 . . . . 0.0 111.545 -177.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.07 -38.76 83.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.191 0.519 . . . . 0.0 110.372 176.021 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.8 -36.16 79.92 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.801 -179.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.487 ' HG2' ' O ' ' A' ' 101' ' ' PHE . 13.0 mm-40 -56.87 -49.17 76.31 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.308 0.575 . . . . 0.0 109.569 179.822 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 45.2 t -59.12 -49.11 79.14 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.04 -0.982 . . . . 0.0 110.923 -179.024 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 28.1 mmm180 -59.46 -47.33 85.9 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.242 -177.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.424 HG21 ' CD2' ' A' ' 43' ' ' PHE . 88.6 t -66.61 -41.54 88.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.156 -178.623 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 65.1 t80 -64.86 -43.43 93.0 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.361 -177.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 5.3 pp0? -69.58 -37.25 76.87 Favored 'General case' 0 C--O 1.239 0.512 0 N-CA-C 111.535 0.198 . . . . 0.0 111.535 -175.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 4.5 pp -73.58 -24.84 60.13 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-O 120.836 0.35 . . . . 0.0 110.2 179.23 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' MET . . . . . 0.614 ' HE1' ' OD1' ' A' ' 40' ' ' ASN . 34.4 ttm -66.38 -50.17 64.39 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.771 -0.65 . . . . 0.0 109.997 175.136 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . 0.565 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 38.2 tt0 -54.88 -57.86 9.91 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.081 -178.127 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -60.88 -9.38 4.08 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 112.963 0.727 . . . . 0.0 112.963 -172.028 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . 0.464 ' O ' ' HG3' ' A' ' 119' ' ' ARG . 32.9 t70 -126.93 -68.85 0.78 Allowed 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 120.61 0.243 . . . . 0.0 111.087 178.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 22.7 t -60.96 -38.38 85.69 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 111.697 0.258 . . . . 0.0 111.697 -175.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . 0.565 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 42.0 t80 -71.52 -40.78 69.88 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 120.722 0.296 . . . . 0.0 110.706 -177.261 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 34.5 p -65.93 -43.73 87.23 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 109.905 -0.405 . . . . 0.0 109.905 177.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . 0.464 ' HG3' ' O ' ' A' ' 115' ' ' ASP . 90.2 mtt180 -55.66 -44.1 76.91 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.135 174.213 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -58.95 -41.98 88.76 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.299 179.188 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 83.6 mt -70.88 -14.86 62.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.811 0.338 . . . . 0.0 111.113 179.134 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . 0.635 ' HE3' ' HA ' ' A' ' 122' ' ' LYS . 0.0 OUTLIER -113.88 7.48 17.0 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.601 179.326 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 97.0 p -84.42 148.95 26.31 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 120.624 0.25 . . . . 0.0 111.041 -179.412 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -60.15 -29.92 68.97 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 174.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 42.0 mm -55.12 -57.09 8.06 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-N 115.261 -0.881 . . . . 0.0 111.167 178.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' TYR . . . . . 0.454 ' O ' ' HG2' ' A' ' 130' ' ' MET . 31.7 t80 -66.22 -38.75 88.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.909 0.385 . . . . 0.0 110.324 -178.236 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 92.1 mt -65.27 -28.57 69.43 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.599 178.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -71.9 -37.56 70.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.001 178.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 81.0 mt -64.6 -31.84 73.23 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.964 176.352 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' MET . . . . . 0.648 ' SD ' HG13 ' A' ' 9' ' ' VAL . 26.2 mmt . . . . . 0 C--O 1.232 0.181 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.769 176.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . 0.461 HG12 HD22 ' A' ' 129' ' ' LEU . 14.7 p . . . . . 0 C--O 1.235 0.313 0 CA-C-O 121.091 0.472 . . . . 0.0 111.901 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 29.5 m -95.58 149.24 35.82 Favored Pre-proline 0 CA--C 1.535 0.372 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.434 173.155 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -44.21 -46.39 11.47 Favored 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 123.623 2.882 . . . . 0.0 113.793 -173.056 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.601 ' O ' HG21 ' A' ' 9' ' ' VAL . 33.9 tt0 -61.78 -47.7 83.96 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 120.696 0.284 . . . . 0.0 111.178 -175.8 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -64.35 -34.96 79.35 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.109 0.48 . . . . 0.0 109.889 178.235 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.61 -38.29 89.64 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.235 -179.605 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.601 HG21 ' O ' ' A' ' 6' ' ' GLU . 11.4 m -75.15 -25.89 18.55 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 C-N-CA 120.92 -0.312 . . . . 0.0 110.63 179.833 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.548 ' HG2' ' O ' ' A' ' 6' ' ' GLU . 74.8 mmtt -60.35 -34.48 73.9 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.008 0.432 . . . . 0.0 110.268 176.86 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . 0.411 ' CE3' HD13 ' A' ' 18' ' ' LEU . 49.1 m0 -61.72 -22.37 65.31 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.802 179.451 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -64.61 -13.03 54.73 Favored Glycine 0 CA--C 1.519 0.31 0 CA-C-N 115.848 -0.614 . . . . 0.0 113.072 -178.098 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.53 ' HG2' ' O ' ' A' ' 10' ' ' LYS . 10.7 pt-20 -79.89 -23.19 42.01 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 117.029 0.415 . . . . 0.0 110.739 179.78 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 31.6 t -171.0 132.01 0.83 Allowed 'General case' 0 C--O 1.238 0.469 0 CA-C-O 121.377 0.608 . . . . 0.0 111.716 -177.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 28.6 t80 -60.86 -29.04 69.29 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.861 174.385 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -55.85 -43.79 77.39 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.508 175.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 33.3 ttmt -66.96 -40.49 87.5 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.479 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.411 HD13 ' CE3' ' A' ' 11' ' ' TRP . 39.1 tp -59.23 -40.5 86.1 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.149 0.499 . . . . 0.0 110.311 175.514 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 39.6 tp -73.86 -36.67 64.86 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.341 -176.429 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 24.6 p -79.56 -23.26 42.92 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.583 -177.017 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.71 114.45 13.15 Favored 'General case' 0 C--O 1.223 -0.304 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 177.193 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.419 ' HD2' ' H ' ' A' ' 22' ' ' ARG . 4.2 mpt_? -56.18 -42.32 76.89 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 120.902 0.382 . . . . 0.0 111.167 -170.709 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -70.18 -33.05 71.27 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.693 176.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -64.72 -54.19 30.13 Favored Glycine 0 C--N 1.332 0.357 0 N-CA-C 111.397 -0.681 . . . . 0.0 111.397 177.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.9 tt -54.63 -40.0 68.53 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 123.085 0.554 . . . . 0.0 110.308 174.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.401 ' O ' ' HG3' ' A' ' 30' ' ' ARG . 36.3 tt0 -60.87 -42.83 98.68 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-O 121.059 0.456 . . . . 0.0 110.305 177.73 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -68.87 -36.88 78.62 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.202 0.525 . . . . 0.0 110.516 178.158 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 77.3 t80 -70.32 -43.22 70.75 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.712 -175.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.588 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 7.2 t -64.85 -44.04 91.05 Favored 'General case' 0 C--N 1.333 -0.137 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 178.658 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.401 ' HG3' ' O ' ' A' ' 26' ' ' GLU . 87.7 mtm180 -57.85 -27.76 63.51 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-O 121.047 0.451 . . . . 0.0 110.651 178.816 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.497 ' O ' HG22 ' A' ' 34' ' ' THR . 75.9 t80 -83.32 -41.17 18.55 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.779 175.036 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 17.5 tp -76.62 -21.26 55.77 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.744 -171.483 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.588 ' HG3' ' O ' ' A' ' 29' ' ' THR . 68.5 mttm -61.68 -30.51 70.78 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.343 -178.855 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.497 HG22 ' O ' ' A' ' 31' ' ' PHE . 9.6 t -65.37 -31.0 71.89 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.077 -175.601 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -102.3 8.05 40.46 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 120.916 0.388 . . . . 0.0 110.79 179.41 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 88.9 m-85 59.79 20.05 8.87 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.897 174.435 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 33.0 t -85.59 1.06 50.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.197 0.522 . . . . 0.0 110.348 -177.429 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.412 ' CD ' ' HZ2' ' A' ' 33' ' ' LYS . 52.1 tt0 -58.91 -30.85 68.12 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.283 -179.595 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.478 ' CD ' ' HZ3' ' A' ' 77' ' ' LYS . 10.7 pt-20 -60.74 -24.16 65.49 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.136 179.772 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . 0.511 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 93.6 m-20 -68.21 -39.96 82.25 Favored 'General case' 0 C--O 1.238 0.459 0 CA-C-O 121.405 0.621 . . . . 0.0 109.424 174.689 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 46.0 mt -63.47 -49.73 81.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.422 173.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.433 ' HA ' ' HB ' ' A' ' 45' ' ' ILE . 49.9 mt-10 -60.85 -27.21 67.93 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.891 178.273 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.511 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 62.5 t80 -58.67 -62.61 1.73 Allowed 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.302 176.694 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.521 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 16.0 p-90 -74.91 -14.61 60.67 Favored 'General case' 0 CA--C 1.528 0.1 0 C-N-CA 119.66 -0.816 . . . . 0.0 111.442 -177.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.433 ' HB ' ' HA ' ' A' ' 42' ' ' GLU . 15.6 mt -61.9 -47.11 94.74 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 167.797 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.83 -30.15 70.27 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.275 177.074 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 25.6 t -62.71 -46.28 88.84 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.455 175.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.521 ' HG2' ' O ' ' A' ' 44' ' ' TRP . 26.7 mm-40 -64.35 -35.09 79.75 Favored 'General case' 0 C--N 1.333 -0.134 0 N-CA-C 110.133 -0.321 . . . . 0.0 110.133 178.534 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -57.61 -47.54 81.88 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 173.234 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.409 ' CZ ' HG23 ' A' ' 59' ' ' ILE . 57.8 t80 -59.73 -39.05 83.43 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.457 177.04 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.456 ' HZ2' ' CD ' ' A' ' 48' ' ' GLU . 53.3 mtpt -72.82 -26.61 61.56 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.807 -177.819 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.463 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 65.1 pttt -105.04 -1.89 25.09 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 111.614 0.227 . . . . 0.0 111.614 -178.329 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 35.6 p -79.37 135.48 36.72 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 110.308 -0.256 . . . . 0.0 110.308 177.531 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.68 154.75 20.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.975 0.417 . . . . 0.0 110.499 -179.828 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 99.58 110.83 3.17 Favored Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 111.115 -0.794 . . . . 0.0 111.115 -176.31 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -51.55 -38.88 65.58 Favored 'Trans proline' 0 C--N 1.352 0.736 0 C-N-CA 122.9 2.4 . . . . 0.0 111.851 -177.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 -54.54 -49.89 69.23 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.119 178.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 8.5 tp-100 -58.16 -43.49 87.43 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.15 -0.932 . . . . 0.0 110.016 -179.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.409 HG23 ' CZ ' ' A' ' 50' ' ' PHE . 46.7 mm -60.88 -46.82 95.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.505 -178.79 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.432 ' O ' ' HG2' ' A' ' 64' ' ' LYS . 12.3 m170 -62.7 -48.14 80.57 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.358 -174.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.577 HD12 ' N ' ' A' ' 62' ' ' LYS . 3.6 pp -72.48 -38.05 68.28 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.47 -176.644 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.577 ' N ' HD12 ' A' ' 61' ' ' LEU . 28.7 mmtp -64.76 -38.68 91.79 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.786 0.327 . . . . 0.0 110.566 177.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.04 -47.61 77.55 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.499 177.014 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.432 ' HG2' ' O ' ' A' ' 60' ' ' HIS . 48.3 mmtm -62.62 -40.79 98.06 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.898 -179.429 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.83 -55.61 28.06 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.355 -178.404 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 68.0 mt -60.99 -35.99 69.09 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 CA-C-O 121.296 0.57 . . . . 0.0 110.244 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.498 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 79.7 t80 -59.2 -67.99 0.32 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.152 -179.432 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -61.51 -31.52 71.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.254 -0.43 . . . . 0.0 112.013 -173.558 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.417 ' HE3' ' CE2' ' A' ' 70' ' ' PHE . 36.4 ttpt -83.03 -32.26 26.98 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.225 0.454 . . . . 0.0 112.225 -172.699 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . 0.417 ' CE2' ' HE3' ' A' ' 69' ' ' LYS . 51.2 m-85 -131.98 -46.87 0.94 Allowed 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 112.894 0.702 . . . . 0.0 112.894 -174.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.498 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 47.7 mm -68.95 -37.14 76.9 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 CA-C-O 120.749 0.309 . . . . 0.0 111.581 -173.215 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.696 ' HG3' ' H ' ' A' ' 74' ' ' ASP . 6.4 tp-100 -57.98 138.29 56.03 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.868 -176.513 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 15.3 m -79.92 9.3 5.5 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.747 0.784 . . . . 0.0 110.708 -179.202 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . 0.696 ' H ' ' HG3' ' A' ' 72' ' ' GLN . 22.0 m-20 -132.9 25.23 4.3 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.245 -0.888 . . . . 0.0 108.744 172.204 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.78 156.02 92.57 Favored Pre-proline 0 CA--C 1.531 0.225 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.031 -178.2 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -62.17 -23.93 75.87 Favored 'Trans proline' 0 C--N 1.35 0.619 0 C-N-CA 122.702 2.268 . . . . 0.0 112.762 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.478 ' HZ3' ' CD ' ' A' ' 39' ' ' GLU . 30.9 mmtp -115.57 -56.84 2.3 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.312 179.167 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 65.8 114.77 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.372 0 O-C-N 123.671 0.607 . . . . 0.0 110.983 -173.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.431 HG13 ' O ' ' A' ' 79' ' ' VAL . 10.6 t -91.88 25.6 0.39 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 CA-C-O 121.118 0.485 . . . . 0.0 110.101 179.187 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 9.5 p30 43.01 27.97 0.12 Allowed 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.821 0.848 . . . . 0.0 112.388 179.277 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.458 HD11 HG22 ' A' ' 85' ' ' THR . 24.5 tp -56.79 145.45 29.3 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.635 -0.712 . . . . 0.0 111.94 -178.47 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -48.03 138.9 8.63 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.135 -0.939 . . . . 0.0 111.808 179.467 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.523 ' HA ' ' HD2' ' A' ' 86' ' ' LYS . 64.5 t80 -64.22 -41.52 96.98 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.826 -174.714 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 85.1 t60 -70.19 -29.5 66.38 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.863 0.363 . . . . 0.0 110.46 -178.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.458 HG22 HD11 ' A' ' 81' ' ' LEU . 25.9 m -69.17 -41.12 77.64 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 175.06 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.523 ' HD2' ' HA ' ' A' ' 83' ' ' PHE . 47.4 mttm -54.77 -46.77 74.45 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.504 171.888 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -52.19 -55.38 21.47 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 114.938 -1.028 . . . . 0.0 110.966 -179.001 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 61.9 t -55.06 -43.19 68.69 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 CA-C-O 121.176 0.513 . . . . 0.0 110.601 -179.317 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 74.3 mt -66.63 -41.63 88.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.949 -178.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 68.7 p -66.86 -18.89 65.6 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.0 0.428 . . . . 0.0 110.955 -179.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 79.8 m-20 -86.97 -31.6 20.53 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.046 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 22.3 p -107.17 -4.61 18.63 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -175.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 8.0 tp -54.3 -28.11 17.89 Favored 'Isoleucine or valine' 0 C--O 1.238 0.493 0 N-CA-C 112.003 0.372 . . . . 0.0 112.003 -174.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.476 HG22 ' HG2' ' A' ' 95' ' ' GLN . 3.4 t -55.1 -48.84 73.03 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.752 177.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.476 ' HG2' HG22 ' A' ' 94' ' ' THR . 21.8 pt20 -162.19 82.02 1.76 Allowed Pre-proline 0 CA--C 1.532 0.261 0 CA-C-O 121.282 0.563 . . . . 0.0 109.871 -177.84 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -85.26 167.23 10.68 Favored 'Trans proline' 0 CA--C 1.531 0.374 0 C-N-CA 123.012 2.475 . . . . 0.0 113.227 -174.332 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 2.9 m -86.34 169.43 12.95 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.109 179.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -50.49 -49.41 55.51 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 122.883 0.473 . . . . 0.0 111.852 -176.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' HIS . . . . . 0.428 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 19.1 m-70 -100.82 33.02 2.93 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 120.86 0.362 . . . . 0.0 111.322 -175.813 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 25.2 p -64.74 -50.27 67.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.946 0.403 . . . . 0.0 110.946 179.053 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -78.59 6.15 9.37 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.528 -179.531 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -58.61 -36.67 74.41 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.163 0.506 . . . . 0.0 110.231 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.9 -44.35 91.21 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.454 174.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.58 -39.3 90.68 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.464 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.491 ' HG2' ' HB2' ' A' ' 44' ' ' TRP . 0.9 OUTLIER -57.48 -52.1 66.76 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 115.958 -0.564 . . . . 0.0 109.751 176.185 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 25.2 t -61.44 -38.3 86.7 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.847 -178.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . 0.559 ' O ' ' HG ' ' A' ' 111' ' ' LEU . 36.7 mmt180 -65.51 -57.1 9.06 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.441 -179.334 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.439 ' HA ' HD11 ' A' ' 111' ' ' LEU . 93.3 t -59.95 -40.58 83.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.892 0.377 . . . . 0.0 110.858 -177.856 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . 0.442 ' HA ' ' HE3' ' A' ' 112' ' ' MET . 3.6 t80 -56.0 -49.61 73.16 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.198 177.591 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . 0.502 ' HG2' ' O ' ' A' ' 107' ' ' ARG . 10.5 pt20 -72.51 -17.73 61.72 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.653 -0.249 . . . . 0.0 111.015 -176.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.559 ' HG ' ' O ' ' A' ' 107' ' ' ARG . 73.3 mt -68.39 -58.65 4.04 Favored 'General case' 0 C--O 1.235 0.312 0 O-C-N 123.189 0.305 . . . . 0.0 110.853 178.609 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' MET . . . . . 0.442 ' HE3' ' HA ' ' A' ' 109' ' ' TYR . 0.1 OUTLIER -75.92 -14.41 60.26 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 120.132 -0.627 . . . . 0.0 110.342 -179.002 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . 0.58 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 39.3 tt0 -60.91 -61.35 2.64 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.145 0.498 . . . . 0.0 109.761 172.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -69.51 5.15 1.47 Allowed 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.816 -0.629 . . . . 0.0 112.595 -173.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -129.4 -66.27 0.82 Allowed 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 120.897 0.379 . . . . 0.0 111.302 176.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 7.4 m -72.64 -28.12 62.55 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.951 -172.276 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . 0.58 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 34.1 t80 -64.89 -46.97 79.51 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 121.219 -0.192 . . . . 0.0 110.691 -179.081 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 31.7 p -64.13 -43.34 95.58 Favored 'General case' 0 C--O 1.239 0.531 0 CA-C-O 121.131 0.491 . . . . 0.0 110.294 179.327 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 51.8 mtt180 -57.33 -42.85 82.71 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.124 175.283 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.403 ' O ' ' HB2' ' A' ' 126' ' ' TYR . 78.4 t80 -61.53 -42.7 99.21 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.385 179.369 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 90.1 mt -60.04 -32.76 71.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.587 -0.279 . . . . 0.0 111.612 -178.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . 0.718 ' HE2' ' HA ' ' A' ' 122' ' ' LYS . 10.0 mmpt? -110.73 11.49 22.62 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 111.998 0.37 . . . . 0.0 111.998 -179.331 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 79.4 p -74.48 156.55 36.8 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-O 120.797 0.332 . . . . 0.0 110.718 177.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -55.63 -30.29 60.71 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.152 175.319 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.454 ' N ' HD12 ' A' ' 125' ' ' ILE . 2.3 mp -63.09 -49.77 82.06 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.218 -178.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' TYR . . . . . 0.403 ' HB2' ' O ' ' A' ' 120' ' ' PHE . 71.0 t80 -65.63 -35.41 80.72 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.777 -177.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 88.7 mt -66.36 -34.84 78.88 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.914 0.388 . . . . 0.0 109.956 176.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -68.86 -33.26 73.51 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.844 -0.616 . . . . 0.0 109.79 175.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.461 HD22 HG12 ' A' ' 3' ' ' VAL . 88.6 mt -74.04 -32.66 63.43 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.386 176.104 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' MET . . . . . 0.709 ' HA ' ' HE3' ' A' ' 130' ' ' MET . 7.5 mmt . . . . . 0 CA--C 1.519 -0.246 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.687 176.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 2.6 p . . . . . 0 CA--C 1.53 0.206 0 CA-C-O 120.766 0.317 . . . . 0.0 110.459 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.6 m -61.74 141.66 94.99 Favored Pre-proline 0 CA--C 1.534 0.339 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.248 178.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -55.22 -35.39 90.99 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 122.564 2.176 . . . . 0.0 111.845 -179.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -65.48 -49.36 69.37 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 178.009 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -55.65 -44.32 77.09 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.112 176.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.34 -57.03 14.81 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.255 -178.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 26.5 m -64.03 -26.06 39.6 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 CA-C-O 120.826 0.346 . . . . 0.0 110.682 -179.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 16.3 tppt? -68.86 -30.16 68.62 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.499 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . 0.452 ' HZ2' ' ND1' ' A' ' 21' ' ' HIS . 54.5 m0 -62.1 -31.52 71.98 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 121.058 0.456 . . . . 0.0 109.926 174.529 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -59.79 -16.44 38.54 Favored Glycine 0 C--N 1.335 0.508 0 CA-C-N 115.787 -0.642 . . . . 0.0 113.518 -175.056 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -116.77 3.86 12.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.624 0.249 . . . . 0.0 110.987 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 43.9 m -152.02 98.01 2.39 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 120.871 0.367 . . . . 0.0 111.136 -178.3 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 57.1 t80 -65.2 -36.0 82.82 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 121.313 0.578 . . . . 0.0 109.554 178.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -58.93 -32.84 69.93 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.278 -0.873 . . . . 0.0 110.325 177.347 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 22.9 ttmm -72.98 -39.17 66.31 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.0 -0.545 . . . . 0.0 109.86 -179.61 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.481 HD23 ' CE1' ' A' ' 117' ' ' TYR . 14.9 tp -56.18 -50.48 71.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.983 174.499 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 34.4 tp -70.55 -31.57 68.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.133 -0.939 . . . . 0.0 111.524 -175.22 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 38.6 p -81.4 -25.77 35.97 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 120.693 0.282 . . . . 0.0 111.113 -179.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . 0.452 ' ND1' ' HZ2' ' A' ' 11' ' ' TRP . 23.8 t-80 -85.29 118.0 24.57 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 179.492 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 39.5 mtm180 -42.24 -54.88 3.52 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.08 0.552 . . . . 0.0 111.751 -177.193 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -57.14 -36.36 70.61 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.265 -179.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -71.98 -51.31 14.97 Favored Glycine 0 N--CA 1.451 -0.302 0 N-CA-C 111.674 -0.57 . . . . 0.0 111.674 -178.468 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 7.0 tt -54.03 -48.16 70.79 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.247 -0.476 . . . . 0.0 110.277 176.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -61.31 -51.23 69.73 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.632 -179.315 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -60.58 -41.62 95.01 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.326 -177.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 77.6 t80 -74.9 -42.17 58.33 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.178 -175.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.449 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 10.6 t -64.66 -43.5 93.42 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 120.966 -0.293 . . . . 0.0 110.418 -176.771 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.46 -33.04 74.32 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 121.073 0.463 . . . . 0.0 110.006 179.315 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.433 ' O ' HG21 ' A' ' 34' ' ' THR . 92.4 t80 -65.95 -48.99 69.51 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.499 178.686 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 19.5 tp -68.77 -26.16 65.08 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.102 0.477 . . . . 0.0 110.882 -175.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.506 ' HG2' ' HB3' ' A' ' 38' ' ' GLU . 68.4 mttm -85.26 -1.17 56.65 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.611 -179.419 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.433 HG21 ' O ' ' A' ' 31' ' ' PHE . 3.8 t -69.79 -33.34 72.25 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 120.937 0.398 . . . . 0.0 110.339 179.755 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -118.79 16.73 13.54 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.356 178.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 83.5 m-85 60.15 28.89 18.5 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 115.418 -0.81 . . . . 0.0 112.009 176.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 21.8 t -82.27 4.71 22.57 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 121.884 0.849 . . . . 0.0 108.779 174.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.506 ' HB3' ' HG2' ' A' ' 33' ' ' LYS . 13.7 pt-20 -56.42 -19.31 14.38 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 114.577 -1.192 . . . . 0.0 111.629 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.419 ' O ' ' HB2' ' A' ' 43' ' ' PHE . 10.1 mm-40 -45.77 -33.07 2.84 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.083 179.384 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . 0.5 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 49.7 m-80 -72.63 -47.49 47.23 Favored 'General case' 0 C--O 1.24 0.581 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.552 -178.434 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.444 ' HA ' ' HE2' ' A' ' 112' ' ' MET . 13.6 tt -70.94 -45.41 73.15 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 -177.257 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.471 ' OE1' ' HB2' ' A' ' 38' ' ' GLU . 4.2 mp0 -63.26 -23.27 67.35 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.65 174.318 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.5 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 66.8 t80 -62.09 -60.85 3.0 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 120.471 0.176 . . . . 0.0 110.776 177.632 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.593 ' HB2' ' HG3' ' A' ' 105' ' ' GLN . 13.1 p-90 -72.92 -9.68 58.97 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 119.258 -0.977 . . . . 0.0 111.513 -177.58 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.415 HG13 ' O ' ' A' ' 41' ' ' ILE . 79.8 mt -79.82 -33.22 14.64 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 166.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.461 ' HA ' ' OD2' ' A' ' 49' ' ' ASP . . . -67.14 -21.62 65.81 Favored 'General case' 0 CA--C 1.522 -0.105 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.64 179.071 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 44.4 t -68.72 -32.82 72.89 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.731 172.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.503 ' O ' ' HG2' ' A' ' 51' ' ' LYS . 17.0 mm-40 -75.17 -49.25 20.06 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.316 179.646 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.483 ' HA ' ' HD3' ' A' ' 52' ' ' LYS . 3.1 p30 -70.32 -11.99 61.28 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.465 177.426 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 24.5 t80 -71.76 -49.2 41.09 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.371 174.201 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.503 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 13.1 ptmm? -62.38 -26.08 68.27 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.891 0.376 . . . . 0.0 109.998 176.855 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.483 ' HD3' ' HA ' ' A' ' 49' ' ' ASP . 51.1 mtpt -67.34 -31.44 71.7 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.674 175.22 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 31.6 m -82.32 51.26 1.77 Allowed 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 121.243 0.544 . . . . 0.0 109.81 178.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.77 16.83 0.08 Allowed 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 114.052 1.131 . . . . 0.0 114.052 -170.186 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . 0.475 ' O ' HG12 ' A' ' 59' ' ' ILE . . . -65.88 130.64 33.5 Favored Glycine 0 CA--C 1.523 0.569 0 C-N-CA 120.555 -0.831 . . . . 0.0 111.211 175.504 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -50.46 -43.93 42.09 Favored 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 123.058 2.505 . . . . 0.0 113.009 -173.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 22.0 tm0? -93.83 -33.15 13.66 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 179.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 25.5 tp60 -54.11 -35.6 62.33 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.958 179.391 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.475 HG12 ' O ' ' A' ' 55' ' ' GLY . 27.1 mm -52.77 -42.25 41.5 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.611 176.201 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 22.8 m-70 -65.63 -45.18 84.04 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.52 -177.466 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 91.0 mt -68.03 -43.65 78.28 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.011 -178.504 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.47 ' NZ ' HD13 ' A' ' 66' ' ' ILE . 8.0 tmtt? -66.35 -40.96 90.13 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.512 -177.105 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.9 -41.3 87.39 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.543 176.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 14.6 tppt? -53.69 -46.99 70.88 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.723 177.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.7 -59.68 4.66 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.579 179.235 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.47 HD13 ' NZ ' ' A' ' 62' ' ' LYS . 66.5 mt -56.73 -35.59 46.28 Favored 'Isoleucine or valine' 0 C--O 1.235 0.336 0 CA-C-O 121.37 0.605 . . . . 0.0 110.522 179.545 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.426 ' OH ' HG23 ' A' ' 90' ' ' THR . 83.1 t80 -62.8 -67.68 0.4 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.171 -176.803 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.479 ' HA ' ' HB2' ' A' ' 72' ' ' GLN . 29.1 mt-10 -77.43 -1.81 32.1 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 -172.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 65.8 tttp -100.57 -28.73 12.73 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 116.865 -0.152 . . . . 0.0 111.334 177.486 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . 0.426 ' HB3' HG23 ' A' ' 79' ' ' VAL . 75.0 m-85 -132.86 -43.98 0.88 Allowed 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -175.657 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 45.5 mm -77.0 -36.59 25.2 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 CA-C-O 120.698 0.285 . . . . 0.0 111.691 -173.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.479 ' HB2' ' HA ' ' A' ' 68' ' ' GLU . 60.0 tp60 -59.25 133.66 56.3 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.829 -175.194 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 37.1 p -61.95 124.06 19.74 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.017 177.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 26.9 t70 70.99 29.9 2.88 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.117 -178.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.414 ' HB1' ' HD2' ' A' ' 76' ' ' PRO . . . -63.65 164.91 13.71 Favored Pre-proline 0 CA--C 1.537 0.445 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.724 171.682 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.414 ' HD2' ' HB1' ' A' ' 75' ' ' ALA . 84.7 Cg_exo -45.18 -57.61 2.02 Favored 'Trans proline' 0 C--N 1.356 0.955 0 C-N-CA 122.499 2.133 . . . . 0.0 111.915 178.834 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.1 72.66 1.47 Allowed 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 171.736 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -68.05 146.76 53.2 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.184 -178.289 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.453 HG13 HG22 ' A' ' 108' ' ' VAL . 53.5 t -85.02 147.05 5.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 176.982 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 46.7 m-80 -77.86 51.8 0.98 Allowed 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 121.606 0.717 . . . . 0.0 110.151 177.723 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 44.8 tp -73.79 147.22 43.62 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.001 -0.999 . . . . 0.0 110.351 178.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -50.34 139.98 14.24 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.431 178.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 47.8 p90 -64.79 -37.35 87.33 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.945 -176.26 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . 0.414 ' O ' ' HB3' ' A' ' 87' ' ' GLU . 72.4 t60 -69.16 -36.61 77.59 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.81 0.338 . . . . 0.0 110.379 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 38.7 m -66.86 -43.99 82.14 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.121 176.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.434 ' O ' HG22 ' A' ' 90' ' ' THR . 95.7 mttt -60.82 -38.56 85.85 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 174.831 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.414 ' HB3' ' O ' ' A' ' 84' ' ' HIS . 43.2 tt0 -56.52 -50.19 72.56 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.41 177.719 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.402 HG21 ' O ' ' A' ' 84' ' ' HIS . 96.2 t -62.42 -51.15 75.85 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.797 179.079 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 71.4 mt -57.73 -49.29 81.29 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.273 -176.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.434 HG22 ' O ' ' A' ' 86' ' ' LYS . 49.1 p -57.66 -39.98 78.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.166 0.507 . . . . 0.0 111.083 -178.473 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 32.9 m-80 -85.61 -4.87 59.28 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.983 -176.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 15.3 m -124.88 0.84 8.04 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.7 tp -66.63 -23.01 30.6 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 CA-C-O 120.761 0.315 . . . . 0.0 111.459 -174.006 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.515 HG22 ' HG2' ' A' ' 95' ' ' GLN . 15.4 t -63.03 -25.31 68.32 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.981 179.298 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.515 ' HG2' HG22 ' A' ' 94' ' ' THR . 11.4 pt20 -151.83 77.25 7.11 Favored Pre-proline 0 CA--C 1.536 0.412 0 CA-C-O 121.236 0.541 . . . . 0.0 110.503 179.596 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . 0.463 ' HG2' HG22 ' A' ' 59' ' ' ILE . 96.4 Cg_endo -88.69 159.31 6.32 Favored 'Trans proline' 0 N--CA 1.461 -0.418 0 C-N-CA 122.768 2.312 . . . . 0.0 112.214 179.134 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' THR . . . . . 0.413 ' H ' ' HB2' ' A' ' 100' ' ' SER . 18.5 p -96.3 172.28 8.05 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.938 176.355 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 10.4 mp -53.29 -30.32 38.07 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 -174.029 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -133.2 31.71 3.79 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.907 0.384 . . . . 0.0 110.513 -176.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' SER . . . . . 0.413 ' HB2' ' H ' ' A' ' 97' ' ' THR . 23.5 t -54.68 -26.02 30.8 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.82 -177.321 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -83.68 17.9 2.11 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.438 -178.703 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -56.94 -50.13 73.53 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.917 0.389 . . . . 0.0 110.965 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.7 -47.97 83.53 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.671 179.074 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . 0.402 ' O ' HG21 ' A' ' 108' ' ' VAL . . . -60.52 -36.81 79.29 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.532 178.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.593 ' HG3' ' HB2' ' A' ' 44' ' ' TRP . 57.3 tt0 -57.29 -44.16 83.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.185 -179.246 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 14.4 m -69.36 -41.72 76.2 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.762 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . 0.476 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 38.4 mmt180 -60.03 -43.94 94.98 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.365 -178.119 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.453 HG22 HG13 ' A' ' 79' ' ' VAL . 83.4 t -69.22 -43.4 81.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.95 0.405 . . . . 0.0 111.068 -177.655 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 25.0 t80 -56.8 -46.22 81.73 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.376 179.293 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . 0.476 ' HG3' ' O ' ' A' ' 107' ' ' ARG . 5.3 pp0? -70.11 -36.46 74.86 Favored 'General case' 0 C--O 1.238 0.485 0 N-CA-C 111.677 0.251 . . . . 0.0 111.677 -175.819 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.488 ' HA ' ' HG2' ' A' ' 114' ' ' GLN . 4.5 pp -74.0 -28.05 61.26 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 120.815 -0.354 . . . . 0.0 110.269 179.415 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' MET . . . . . 0.444 ' HE2' ' HA ' ' A' ' 41' ' ' ILE . 44.2 ttm -61.89 -39.63 92.61 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.563 175.162 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . 0.439 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 3.2 tm-20 -59.79 -60.88 3.13 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.624 -0.717 . . . . 0.0 110.164 177.56 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . 0.488 ' HG2' ' HA ' ' A' ' 111' ' ' LEU . 13.7 pt20 -64.63 -18.13 64.65 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -173.072 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -110.28 -67.27 1.0 Allowed 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.138 0.494 . . . . 0.0 111.71 -179.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 17.4 m -72.5 -31.45 65.37 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.696 -172.589 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . 0.481 ' CE1' HD23 ' A' ' 18' ' ' LEU . 18.3 t80 -81.72 -36.91 28.09 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.175 -0.61 . . . . 0.0 110.924 -177.602 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 22.0 p -60.04 -47.49 85.65 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-O 120.905 0.384 . . . . 0.0 110.45 178.353 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 14.7 ptp180 -61.49 -36.07 79.44 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 176.025 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -65.56 -33.84 76.85 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.557 177.343 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 86.3 mt -65.15 -28.69 69.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.028 0.442 . . . . 0.0 110.196 176.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 3.7 tppp? -93.44 -9.86 37.08 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.379 179.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 60.7 p -59.85 146.84 40.52 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-O 121.153 0.501 . . . . 0.0 111.578 -176.301 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -59.73 -38.03 80.56 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.173 179.31 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.446 ' O ' ' HG ' ' A' ' 129' ' ' LEU . 0.0 OUTLIER -64.49 -47.04 90.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.66 -176.922 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -66.38 -48.35 70.4 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 120.877 0.37 . . . . 0.0 111.132 -177.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 95.5 mt -63.37 -29.59 70.87 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.871 -179.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -67.79 -39.23 84.04 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.668 177.079 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 125' ' ' ILE . 97.8 mt -61.15 -47.86 84.24 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.988 -179.103 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' MET . . . . . . . . . . . . . 14.8 ptp . . . . . 0 C--N 1.33 -0.24 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.249 -178.846 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 6.8 p . . . . . 0 C--O 1.234 0.243 0 CA-C-O 120.89 0.376 . . . . 0.0 111.56 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 17.3 m -100.17 148.19 34.54 Favored Pre-proline 0 CA--C 1.535 0.383 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.743 175.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo -49.27 -44.22 34.68 Favored 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 123.057 2.505 . . . . 0.0 113.232 -177.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.417 ' HA ' HG21 ' A' ' 9' ' ' VAL . 32.6 mt-10 -70.61 -24.38 62.73 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.222 -177.175 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 21.2 tp10 -73.21 -34.33 65.88 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 173.187 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.757 ' HB1' ' SD ' ' A' ' 130' ' ' MET . . . -66.68 -42.22 86.85 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.048 179.789 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.417 HG21 ' HA ' ' A' ' 6' ' ' GLU . 27.1 m -68.26 -25.69 32.2 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 CA-C-O 120.971 0.415 . . . . 0.0 110.195 175.594 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.463 ' CG ' ' HZ3' ' A' ' 17' ' ' LYS . 16.9 tppt? -69.58 -27.86 65.48 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.007 174.074 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 46.8 m0 -72.15 -35.27 69.02 Favored 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 171.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -69.0 -2.64 32.03 Favored Glycine 0 N--CA 1.452 -0.298 0 CA-C-N 115.15 -0.932 . . . . 0.0 113.568 -176.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -115.42 4.44 14.33 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 117.048 0.424 . . . . 0.0 110.507 176.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.1 p -161.46 92.95 0.91 Allowed 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 121.039 0.447 . . . . 0.0 111.101 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.402 ' CE1' HD21 ' A' ' 18' ' ' LEU . 13.1 t80 -58.27 -38.6 77.28 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.007 177.851 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -48.88 -42.07 35.47 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.389 173.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.463 ' HZ3' ' CG ' ' A' ' 10' ' ' LYS . 87.4 tttt -76.12 -27.37 57.05 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.26 -178.473 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.402 HD21 ' CE1' ' A' ' 15' ' ' PHE . 52.8 tp -59.15 -43.27 92.04 Favored 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 110.054 -0.35 . . . . 0.0 110.054 179.008 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -75.31 -32.02 60.84 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.374 176.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 43.3 t -61.72 -35.3 77.64 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.476 178.093 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -80.56 115.08 19.89 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 177.195 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.31 -44.3 54.05 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 121.254 0.549 . . . . 0.0 110.583 177.084 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -72.39 -28.23 62.86 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.827 -178.507 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -71.01 -44.83 54.2 Favored Glycine 0 N--CA 1.451 -0.324 0 N-CA-C 111.063 -0.815 . . . . 0.0 111.063 177.084 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.3 tt -62.57 -41.46 98.95 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.923 -0.639 . . . . 0.0 110.481 177.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.483 ' O ' ' HG2' ' A' ' 30' ' ' ARG . 43.6 tt0 -58.84 -47.84 83.43 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.876 0.37 . . . . 0.0 110.211 177.473 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -63.61 -40.86 98.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.963 0.411 . . . . 0.0 110.78 179.241 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 73.2 t80 -64.53 -45.4 87.36 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.071 -177.202 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.536 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 9.7 t -66.54 -41.67 88.35 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 120.91 -0.316 . . . . 0.0 110.558 -179.451 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.483 ' HG2' ' O ' ' A' ' 26' ' ' GLU . 12.1 mmt180 -54.1 -36.01 62.76 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 120.994 0.426 . . . . 0.0 110.395 178.651 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.427 ' O ' HG23 ' A' ' 34' ' ' THR . 63.4 t80 -70.62 -53.73 14.76 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.543 175.579 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 28.2 tp -64.07 -24.1 67.58 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.91 -173.181 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.536 ' HG3' ' O ' ' A' ' 29' ' ' THR . 68.5 mttm -65.02 -14.05 59.43 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 116.749 -0.205 . . . . 0.0 111.336 179.58 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.427 HG23 ' O ' ' A' ' 31' ' ' PHE . 14.3 t -62.82 -34.51 77.46 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 120.851 0.358 . . . . 0.0 110.7 179.275 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -115.76 7.94 14.75 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.13 -175.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 92.5 m-85 59.54 17.09 5.79 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 115.942 -0.572 . . . . 0.0 112.542 173.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 8.4 t -86.86 27.57 0.99 Allowed 'General case' 0 C--O 1.235 0.3 0 CA-C-O 121.63 0.729 . . . . 0.0 109.638 -179.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 64.6 tt0 -71.83 -13.62 61.73 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.956 -177.177 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.45 ' HB3' ' HB3' ' A' ' 77' ' ' LYS . 0.8 OUTLIER -55.74 -26.61 46.39 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 111.704 0.261 . . . . 0.0 111.704 -178.354 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 57.3 m-80 -61.65 -50.15 73.68 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-O 121.625 0.726 . . . . 0.0 109.944 173.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 61.7 mt -63.5 -49.72 81.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.935 178.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -57.96 -30.87 66.35 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.805 177.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 79.1 t80 -58.69 -63.23 1.36 Allowed 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.502 179.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.576 ' HA ' ' SG ' ' A' ' 47' ' ' CYS . 6.2 p-90 -79.05 -5.99 55.34 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 119.545 -0.862 . . . . 0.0 112.148 -178.778 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 8.8 mt -69.37 -45.88 77.91 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 166.335 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.45 -32.04 73.49 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.326 177.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.576 ' SG ' ' HA ' ' A' ' 44' ' ' TRP . 73.6 m -64.35 -30.72 71.76 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.801 177.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.426 ' O ' ' HG3' ' A' ' 51' ' ' LYS . 39.8 tt0 -77.0 -40.86 45.14 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 178.011 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -61.44 -31.64 71.59 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 121.525 0.679 . . . . 0.0 109.671 173.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.464 ' CZ ' HG21 ' A' ' 59' ' ' ILE . 56.4 t80 -65.36 -52.67 52.12 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 114.911 -1.04 . . . . 0.0 111.162 178.709 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.426 ' HG3' ' O ' ' A' ' 48' ' ' GLU . 0.0 OUTLIER -68.87 -21.49 64.26 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 121.347 0.594 . . . . 0.0 110.028 179.749 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 8.8 tttm -69.68 -19.71 63.58 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.271 173.363 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 15.5 m -84.29 43.66 0.97 Allowed 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.517 179.041 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.19 98.47 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.678 0.752 . . . . 0.0 112.407 -177.477 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . 0.498 ' O ' HG12 ' A' ' 59' ' ' ILE . . . -179.91 129.15 1.3 Allowed Glycine 0 C--O 1.226 -0.392 0 N-CA-C 110.624 -0.99 . . . . 0.0 110.624 176.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_endo -46.29 -58.23 1.79 Allowed 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.951 2.434 . . . . 0.0 112.997 -172.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -71.16 -38.15 72.19 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 120.978 0.418 . . . . 0.0 110.543 -178.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.575 ' OE1' HD13 ' A' ' 61' ' ' LEU . 5.4 tp-100 -57.46 -42.31 82.32 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.489 -178.357 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.498 HG12 ' O ' ' A' ' 55' ' ' GLY . 36.9 mm -58.46 -47.12 89.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.312 -178.69 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 16.6 m-70 -64.76 -46.04 83.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.277 -174.499 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.575 HD13 ' OE1' ' A' ' 58' ' ' GLN . 4.5 pp -71.59 -33.23 68.86 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.127 -176.928 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.469 ' N ' HD12 ' A' ' 61' ' ' LEU . 12.3 mmmm -68.55 -42.67 78.05 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 110.095 -0.335 . . . . 0.0 110.095 176.061 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.22 -39.48 90.41 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.372 177.305 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.461 ' O ' ' HB3' ' A' ' 67' ' ' TYR . 4.0 tmtp? -65.3 -38.22 89.53 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.898 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -65.36 -49.85 67.78 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.137 0.494 . . . . 0.0 110.303 177.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 70.8 mt -61.66 -30.65 48.74 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.069 177.128 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.515 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 78.2 t80 -58.85 -58.32 9.14 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.494 178.334 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -70.09 -26.65 64.08 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.88 -0.6 . . . . 0.0 112.095 -172.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 35.2 ttpt -99.87 -28.31 13.18 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 -174.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -120.27 -45.27 2.45 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -176.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.515 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 44.2 mm -76.64 -22.6 15.12 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 CA-C-O 120.573 0.225 . . . . 0.0 110.984 -173.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.464 ' HG3' ' H ' ' A' ' 74' ' ' ASP . 6.3 tp60 -50.54 148.18 4.02 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.735 176.601 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 26.1 m -57.48 -42.85 83.47 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.267 -179.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . 0.464 ' H ' ' HG3' ' A' ' 72' ' ' GLN . 6.7 m-20 -82.88 -72.4 0.45 Allowed 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.281 -179.44 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . 69.24 134.71 0.04 OUTLIER Pre-proline 0 CA--C 1.535 0.403 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.761 -177.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -59.33 -35.76 96.05 Favored 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 122.587 2.191 . . . . 0.0 112.044 -178.39 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.45 ' HB3' ' HB3' ' A' ' 39' ' ' GLU . 14.1 mmmm -87.88 -15.61 36.24 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.575 178.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 58.73 83.14 0.13 Allowed 'General case' 0 C--O 1.236 0.387 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.018 -177.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 35.9 t -80.93 140.74 16.18 Favored 'Isoleucine or valine' 0 C--O 1.234 0.275 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.48 -176.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 23.9 m-80 -88.54 11.26 17.7 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.118 -0.492 . . . . 0.0 112.025 -172.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.475 HD12 HG21 ' A' ' 85' ' ' THR . 25.7 tp -59.15 145.0 44.09 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -175.336 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.457 ' O ' ' HG3' ' A' ' 86' ' ' LYS . 10.9 t70 -55.64 145.33 23.92 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 115.044 -0.98 . . . . 0.0 112.543 -177.76 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 45.7 p90 -67.3 -42.46 83.69 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.812 -175.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . 0.481 ' O ' ' HB3' ' A' ' 87' ' ' GLU . 69.4 t60 -69.15 -29.51 67.56 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.898 0.38 . . . . 0.0 110.341 -177.849 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.534 ' OG1' ' HG3' ' A' ' 107' ' ' ARG . 22.1 m -67.15 -45.97 75.48 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 176.589 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.457 ' HG3' ' O ' ' A' ' 82' ' ' ASP . 26.3 mtpp -56.65 -39.08 73.08 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 109.26 -0.645 . . . . 0.0 109.26 175.24 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.481 ' HB3' ' O ' ' A' ' 84' ' ' HIS . 56.1 tt0 -58.18 -53.83 53.89 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.601 177.639 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.431 HG21 ' O ' ' A' ' 84' ' ' HIS . 96.9 t -55.14 -43.2 69.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.071 0.462 . . . . 0.0 110.312 179.446 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.407 HG13 ' O ' ' A' ' 85' ' ' THR . 73.9 mt -65.25 -42.43 93.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.091 -179.394 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 41.1 p -64.38 -18.39 64.63 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 120.93 0.395 . . . . 0.0 111.031 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 47.6 m-80 -88.85 -41.56 12.4 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.564 174.472 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 22.8 t -87.83 0.54 55.66 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.572 -174.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 8.9 tp -57.12 -29.1 31.04 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.383 0 CA-C-O 120.945 0.402 . . . . 0.0 111.143 -179.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 9.0 t -68.27 -33.88 75.17 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.826 179.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 75.5 mm-40 -139.25 80.32 23.49 Favored Pre-proline 0 C--O 1.234 0.276 0 CA-C-O 120.988 0.423 . . . . 0.0 110.955 -178.067 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . 0.489 ' HG2' HG22 ' A' ' 59' ' ' ILE . 89.5 Cg_endo -85.72 133.63 4.42 Favored 'Trans proline' 0 N--CA 1.46 -0.461 0 C-N-CA 122.685 2.257 . . . . 0.0 111.774 174.36 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' THR . . . . . 0.437 ' N ' ' HB2' ' A' ' 100' ' ' SER . 9.5 p -83.22 176.2 9.35 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.71 176.676 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -52.14 -45.98 65.2 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.042 0.448 . . . . 0.0 111.229 -175.108 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 7.7 t-80 -116.78 31.85 6.5 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.754 -176.58 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' SER . . . . . 0.437 ' HB2' ' N ' ' A' ' 97' ' ' THR . 20.8 t -45.87 -40.09 9.51 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.633 -0.712 . . . . 0.0 112.683 -172.797 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 -76.04 16.5 0.42 Allowed 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 112.001 0.371 . . . . 0.0 112.001 -177.131 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -58.47 -46.99 85.48 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 121.08 0.466 . . . . 0.0 110.786 178.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.78 -42.89 90.06 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.403 178.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.0 -36.71 85.28 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.649 179.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -57.56 -51.44 69.48 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.419 177.327 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' SER . . . . . 0.632 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 31.4 t -57.3 -48.55 78.64 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.211 179.655 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . 0.534 ' HG3' ' OG1' ' A' ' 85' ' ' THR . 24.9 mmt180 -53.42 -54.85 30.93 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.317 -179.337 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.502 ' HA ' HD11 ' A' ' 111' ' ' LEU . 98.7 t -60.16 -40.21 82.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.563 -179.604 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . 0.586 ' HA ' ' SD ' ' A' ' 112' ' ' MET . 28.5 t80 -57.25 -41.21 79.18 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.147 178.718 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . 0.632 ' HG3' ' O ' ' A' ' 106' ' ' SER . 48.9 mt-30 -63.46 -39.94 95.81 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 121.55 0.69 . . . . 0.0 109.816 178.659 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.526 ' HG ' ' O ' ' A' ' 107' ' ' ARG . 93.9 mt -59.33 -49.11 79.09 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 114.581 -1.191 . . . . 0.0 111.934 -173.16 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' MET . . . . . 0.586 ' SD ' ' HA ' ' A' ' 109' ' ' TYR . 0.0 OUTLIER -91.07 -5.62 54.95 Favored 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 120.364 -0.534 . . . . 0.0 110.956 -179.188 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . 0.619 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 42.3 tt0 -69.97 -66.43 0.59 Allowed 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 174.496 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 28.3 pt20 -51.85 -31.73 29.06 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.579 -177.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -98.65 -72.15 0.66 Allowed 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.653 -177.003 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 14.4 m -71.27 -31.46 67.52 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -168.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . 0.619 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 15.7 t80 -64.48 -57.34 9.5 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 117.829 0.286 . . . . 0.0 110.633 -178.55 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 39.5 p -60.09 -46.65 88.88 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 121.372 0.606 . . . . 0.0 110.327 179.1 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 20.5 ttp85 -61.0 -31.3 70.91 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.831 178.633 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 86.0 t80 -70.87 -39.73 72.71 Favored 'General case' 0 C--O 1.225 -0.218 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 177.09 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 87.9 mt -62.34 -22.53 66.15 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.932 0.396 . . . . 0.0 110.403 178.023 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -101.44 -11.98 18.93 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.998 177.299 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 82.7 p -65.44 144.59 56.96 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 120.662 0.268 . . . . 0.0 111.013 -175.322 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -57.62 -31.14 65.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.214 177.076 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 2.3 mp -52.71 -53.18 21.99 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 CA-C-O 121.298 0.57 . . . . 0.0 110.254 175.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -61.91 -48.3 81.09 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.597 -178.114 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.471 ' HA ' ' HB2' ' A' ' 130' ' ' MET . 3.9 mm? -68.05 -20.35 64.97 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.106 -179.507 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -76.92 -26.27 53.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.065 0.46 . . . . 0.0 110.192 177.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 70.8 mt -82.49 -34.86 27.85 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 107.268 -1.382 . . . . 0.0 107.268 175.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' MET . . . . . 0.757 ' SD ' ' HB1' ' A' ' 8' ' ' ALA . 83.2 mmm . . . . . 0 N--CA 1.442 -0.855 0 CA-C-N 113.272 -1.785 . . . . 0.0 110.656 178.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . 0.488 HG22 ' HB3' ' A' ' 7' ' ' GLU . 1.5 p . . . . . 0 CA--C 1.532 0.257 0 CA-C-O 121.122 0.487 . . . . 0.0 111.349 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 45.1 t -80.73 154.46 73.39 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.536 175.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_endo -48.12 -36.64 29.0 Favored 'Trans proline' 0 C--N 1.353 0.773 0 C-N-CA 122.701 2.268 . . . . 0.0 112.108 176.188 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.485 ' O ' ' HG2' ' A' ' 10' ' ' LYS . 33.5 mt-10 -70.28 -32.36 70.13 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 121.282 0.563 . . . . 0.0 110.543 178.421 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.488 ' HB3' HG22 ' A' ' 3' ' ' VAL . 18.9 tp10 -71.99 -32.63 67.4 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 176.583 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.94 -46.53 84.3 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.855 178.553 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.432 HG22 ' O ' ' A' ' 6' ' ' GLU . 19.8 m -66.45 -26.65 38.17 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.23 0 C-N-CA 121.054 -0.258 . . . . 0.0 110.491 179.026 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.485 ' HG2' ' O ' ' A' ' 6' ' ' GLU . 74.2 mmtt -62.81 -44.32 96.46 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.952 0.406 . . . . 0.0 110.016 172.334 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 39.0 m0 -64.49 -27.61 69.1 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.27 0.557 . . . . 0.0 109.863 176.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -76.99 -14.51 82.56 Favored Glycine 0 N--CA 1.449 -0.499 0 CA-C-N 115.326 -0.852 . . . . 0.0 112.647 178.47 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -69.84 -50.83 38.88 Favored 'General case' 0 CA--C 1.521 -0.173 0 CA-C-O 121.203 0.525 . . . . 0.0 110.279 178.129 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 28.6 m -152.45 134.07 14.61 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.602 -175.073 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.418 ' CE1' HD23 ' A' ' 18' ' ' LEU . 1.7 t80 -60.29 -35.06 74.71 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.478 -178.205 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -65.03 -32.98 74.97 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.459 179.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.618 ' HB2' ' HZ2' ' A' ' 17' ' ' LYS . 4.3 ttmp? -65.95 -38.46 88.64 Favored 'General case' 0 N--CA 1.464 0.253 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 177.146 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.418 HD23 ' CE1' ' A' ' 15' ' ' PHE . 56.5 tp -58.22 -46.81 85.2 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.947 174.677 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.426 ' HG ' ' HH2' ' A' ' 44' ' ' TRP . 6.7 mp -62.77 -37.56 87.14 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.191 177.631 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 52.4 m -73.06 -11.7 60.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.341 -177.531 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -98.26 114.18 26.37 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 179.549 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 10.7 mmt85 -50.27 -48.53 54.78 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.091 0.472 . . . . 0.0 111.129 177.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -69.25 -19.25 63.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.511 -179.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -80.47 -44.67 8.47 Favored Glycine 0 C--N 1.334 0.436 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.594 178.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 7.1 tp -50.51 -51.66 45.49 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.542 0.686 . . . . 0.0 109.913 173.2 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.44 ' O ' ' HG3' ' A' ' 30' ' ' ARG . 9.0 tp10 -58.93 -52.99 63.36 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.603 -1.18 . . . . 0.0 110.703 -178.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -58.38 -39.54 79.9 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.993 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -67.11 -49.26 65.55 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.801 -178.487 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.503 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 14.6 t -66.2 -36.68 83.7 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 110.363 -0.236 . . . . 0.0 110.363 -177.254 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.44 ' HG3' ' O ' ' A' ' 26' ' ' GLU . 62.9 mtp180 -57.52 -41.9 81.75 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 120.888 0.375 . . . . 0.0 110.513 176.889 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.532 ' O ' HG21 ' A' ' 34' ' ' THR . 51.3 t80 -72.64 -43.79 62.74 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.453 176.621 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.481 HD23 ' OD1' ' A' ' 40' ' ' ASN . 19.4 tp -62.08 -28.56 69.7 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.184 -174.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.532 ' HG2' ' HB3' ' A' ' 38' ' ' GLU . 99.2 mttt -79.78 -4.87 53.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.534 -179.583 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.532 HG21 ' O ' ' A' ' 31' ' ' PHE . 1.0 OUTLIER -84.62 -17.74 37.7 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 176.039 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -113.44 0.73 14.83 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.747 177.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 48.0 t80 68.28 16.79 9.33 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.804 174.708 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 31.7 m -85.28 9.17 16.03 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 121.099 0.476 . . . . 0.0 110.327 177.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.532 ' HB3' ' HG2' ' A' ' 33' ' ' LYS . 10.0 pt-20 -56.31 -19.31 13.76 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.429 -0.805 . . . . 0.0 112.454 -177.515 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.401 ' CD ' ' HZ3' ' A' ' 77' ' ' LYS . 5.7 mm-40 -50.04 -37.92 35.46 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.341 -179.744 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . 0.526 ' ND2' ' HB3' ' A' ' 112' ' ' MET . 28.6 p30 -81.23 -39.04 25.98 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-N 115.934 -0.576 . . . . 0.0 112.224 -172.272 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.443 HG21 ' O ' ' A' ' 38' ' ' GLU . 9.8 tp -65.8 -43.64 93.26 Favored 'Isoleucine or valine' 0 C--O 1.234 0.254 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 -179.419 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.32 -31.8 72.81 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.735 176.359 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.408 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 81.7 t80 -55.11 -70.19 0.11 Allowed 'General case' 0 C--O 1.238 0.491 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.558 179.805 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.426 ' HH2' ' HG ' ' A' ' 19' ' ' LEU . 28.4 p-90 -81.72 -15.82 53.15 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 119.854 -0.738 . . . . 0.0 112.67 -171.418 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 10.8 tt -67.13 -35.76 75.15 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 173.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.49 -36.64 83.24 Favored 'General case' 0 N--CA 1.456 -0.128 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.574 173.546 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 72.8 m -66.32 -24.62 66.56 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.075 176.678 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.51 ' HA ' ' HB2' ' A' ' 51' ' ' LYS . 12.6 mm-40 -83.37 -22.87 32.67 Favored 'General case' 0 C--O 1.233 0.218 0 O-C-N 122.272 -0.268 . . . . 0.0 110.556 175.644 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.429 ' HA ' ' HG2' ' A' ' 52' ' ' LYS . 24.5 t70 -68.06 -42.56 80.28 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 168.327 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.419 ' CE1' HG21 ' A' ' 59' ' ' ILE . 6.3 t80 -57.02 -32.87 66.61 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.711 -1.132 . . . . 0.0 110.197 170.282 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.534 ' HB2' ' NZ ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -73.45 -40.42 64.19 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.297 -176.905 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.429 ' HG2' ' HA ' ' A' ' 49' ' ' ASP . 7.0 ptmm? -74.78 -26.63 59.88 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 120.579 0.228 . . . . 0.0 111.154 179.667 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 28.8 p -77.84 67.34 3.69 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-O 121.174 0.512 . . . . 0.0 109.691 175.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.767 ' HB2' ' HZ2' ' A' ' 54' ' ' LYS . 0.0 OUTLIER -77.08 16.96 0.49 Allowed 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.387 -0.824 . . . . 0.0 113.162 -170.937 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -68.94 133.78 27.06 Favored Glycine 0 CA--C 1.52 0.398 0 C-N-CA 120.451 -0.881 . . . . 0.0 110.937 176.052 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -54.21 -42.1 70.25 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.729 2.286 . . . . 0.0 112.642 -174.177 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -89.07 -29.1 19.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.17 0.51 . . . . 0.0 109.908 179.005 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.484 ' OE1' HD12 ' A' ' 61' ' ' LEU . 4.7 tp-100 -56.23 -42.25 76.99 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.714 178.296 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.419 HG21 ' CE1' ' A' ' 50' ' ' PHE . 29.9 mm -54.58 -39.6 46.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.308 178.295 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 19.9 m-70 -66.02 -52.06 52.67 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.185 -175.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.484 HD12 ' OE1' ' A' ' 58' ' ' GLN . 4.6 pp -69.74 -32.21 70.62 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.964 -177.459 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.482 ' N ' HD11 ' A' ' 61' ' ' LEU . 66.6 mmtt -66.69 -43.65 83.83 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 121.174 0.512 . . . . 0.0 109.997 174.91 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.22 -47.54 85.55 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.952 -179.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 3.5 tppp? -63.66 -35.37 80.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.502 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.83 -53.27 59.9 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.048 0.451 . . . . 0.0 110.401 177.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 65.5 mt -62.9 -37.62 79.71 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.392 178.154 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.526 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 71.9 t80 -57.21 -56.87 16.22 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.735 -179.487 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.412 ' HA ' ' HG2' ' A' ' 72' ' ' GLN . 42.8 mt-10 -70.69 -30.09 66.57 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.529 -175.203 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 58.2 tttm -90.9 -19.04 23.78 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.723 -173.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 99.4 m-85 -136.35 -53.2 0.73 Allowed 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -176.052 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.526 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 45.7 mm -73.1 -24.09 20.58 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -167.433 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.412 ' HG2' ' HA ' ' A' ' 68' ' ' GLU . 13.5 mm-40 -53.67 139.88 30.91 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 120.851 0.358 . . . . 0.0 111.244 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 65.2 m -71.97 69.68 0.73 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.609 0.719 . . . . 0.0 110.089 176.25 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 21.2 t70 170.59 -76.69 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 107.406 -1.331 . . . . 0.0 107.406 -178.274 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . 59.95 149.07 0.08 OUTLIER Pre-proline 0 CA--C 1.538 0.493 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 169.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -67.43 -20.07 48.5 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 122.508 2.139 . . . . 0.0 111.625 173.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.744 ' HA ' ' HE2' ' A' ' 77' ' ' LYS . 11.2 mmpt? -105.25 -19.7 13.73 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.149 -179.379 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 52.19 77.98 0.14 Allowed 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 121.317 0.58 . . . . 0.0 110.082 -175.704 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 59.0 t -84.94 117.52 30.35 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.95 -175.605 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -80.23 77.39 6.97 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.35 0.595 . . . . 0.0 110.35 179.261 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 20.5 tp -110.75 148.06 33.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.891 176.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.404 ' HB2' ' HG1' ' A' ' 85' ' ' THR . 2.8 m-20 -49.57 128.61 17.92 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.285 -178.271 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 38.2 p90 -52.19 -42.78 63.79 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.412 -179.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . 0.431 ' O ' HG22 ' A' ' 88' ' ' VAL . 68.7 t60 -68.07 -39.7 82.91 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.674 -0.239 . . . . 0.0 110.88 -178.385 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.404 ' HG1' ' HB2' ' A' ' 82' ' ' ASP . 40.6 m -63.71 -46.49 85.24 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.917 0.389 . . . . 0.0 110.547 -179.26 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 12.0 ptmm? -72.12 -21.95 61.4 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.153 179.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -69.92 -46.54 65.14 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.227 174.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.431 HG22 ' O ' ' A' ' 84' ' ' HIS . 87.6 t -54.84 -36.98 39.3 Favored 'Isoleucine or valine' 0 C--O 1.235 0.32 0 CA-C-O 121.287 0.565 . . . . 0.0 109.61 175.242 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 74.4 mt -63.15 -46.48 95.84 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.71 176.304 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 72.1 p -63.94 -22.57 66.98 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.067 0.46 . . . . 0.0 111.094 -179.215 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 79.6 m-20 -85.6 -31.1 22.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.542 178.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 20.7 m -98.2 -1.84 41.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.469 -176.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 11.0 tp -66.33 -15.01 18.47 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 CA-C-O 121.106 0.479 . . . . 0.0 111.238 -176.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 8.0 t -89.3 -6.95 56.31 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.909 178.487 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.487 ' N ' ' HD3' ' A' ' 96' ' ' PRO . 25.5 pt20 -160.79 56.92 0.81 Allowed Pre-proline 0 CA--C 1.536 0.43 0 CA-C-O 120.973 0.416 . . . . 0.0 110.495 -179.132 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . 0.487 ' HD3' ' N ' ' A' ' 95' ' ' GLN . 23.9 Cg_exo -63.06 134.19 44.82 Favored 'Trans proline' 0 C--N 1.351 0.698 0 C-N-CA 122.798 2.332 . . . . 0.0 112.501 -174.4 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' THR . . . . . 0.403 ' H ' ' HB2' ' A' ' 100' ' ' SER . 52.7 p -90.87 168.84 11.41 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.434 176.454 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 34.9 tp -55.54 -47.1 76.85 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 120.972 0.415 . . . . 0.0 111.151 -177.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' HIS . . . . . 0.437 ' HB3' ' HB2' ' A' ' 102' ' ' ASP . 45.9 m-70 -108.67 36.98 2.65 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.818 0.342 . . . . 0.0 110.492 178.558 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' SER . . . . . 0.403 ' HB2' ' H ' ' A' ' 97' ' ' THR . 15.6 t -59.22 -48.98 79.61 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.064 0.459 . . . . 0.0 110.511 178.341 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.473 ' O ' ' HG3' ' A' ' 105' ' ' GLN . 84.3 m-85 -80.21 -1.52 40.91 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.591 -177.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . 0.437 ' HB2' ' HB3' ' A' ' 99' ' ' HIS . 16.1 t70 -52.88 -42.71 65.54 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 120.993 0.425 . . . . 0.0 110.608 -176.875 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.575 ' O ' ' HG2' ' A' ' 107' ' ' ARG . . . -57.22 -51.31 69.85 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.464 176.699 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.69 -40.18 87.02 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.979 -179.314 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.473 ' HG3' ' O ' ' A' ' 101' ' ' PHE . 25.9 mt-30 -60.63 -43.86 97.04 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.921 178.645 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 25.8 t -62.23 -37.43 85.38 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.605 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . 0.575 ' HG2' ' O ' ' A' ' 103' ' ' ALA . 16.3 mmm180 -65.42 -60.53 2.86 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.051 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 53.7 t -53.46 -40.66 41.82 Favored 'Isoleucine or valine' 0 C--O 1.239 0.54 0 CA-C-O 121.39 0.614 . . . . 0.0 110.865 178.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . 0.55 ' HA ' ' HE2' ' A' ' 112' ' ' MET . 30.4 t80 -60.68 -51.89 67.44 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.312 -179.88 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . 0.57 ' NE2' HD11 ' A' ' 111' ' ' LEU . 0.0 OUTLIER -61.81 -28.83 69.75 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 120.485 0.183 . . . . 0.0 110.509 -175.189 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.57 HD11 ' NE2' ' A' ' 110' ' ' GLN . 10.1 mp -60.56 -68.1 0.33 Allowed 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.316 175.179 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' MET . . . . . 0.55 ' HE2' ' HA ' ' A' ' 109' ' ' TYR . 0.0 OUTLIER -68.97 -12.46 61.69 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.475 -175.171 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . 0.544 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 44.5 tt0 -64.43 -63.8 1.04 Allowed 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 172.637 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 29.8 pt20 -68.62 -20.69 64.5 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.463 -175.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -95.3 -63.09 1.2 Allowed 'General case' 0 C--O 1.233 0.214 0 CA-C-O 120.748 0.308 . . . . 0.0 111.588 -179.289 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 23.8 m -86.22 -37.23 18.87 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 112.709 0.633 . . . . 0.0 112.709 -170.642 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . 0.544 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 31.3 t80 -64.25 -37.44 87.5 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 120.866 -0.333 . . . . 0.0 110.751 -176.036 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 24.5 p -59.45 -46.38 88.92 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 121.533 0.682 . . . . 0.0 109.74 175.15 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 22.4 mmt180 -60.81 -38.49 85.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.48 176.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -61.04 -41.12 95.98 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.444 178.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 87.6 mt -69.36 -22.63 63.72 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.309 -178.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . 0.72 ' HE3' ' HA ' ' A' ' 122' ' ' LYS . 0.0 OUTLIER -115.38 15.02 16.86 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.598 0.237 . . . . 0.0 111.602 178.61 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 96.2 p -74.7 145.86 42.76 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 120.939 0.4 . . . . 0.0 111.117 -179.217 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -56.08 -36.59 68.27 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.802 176.735 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.516 ' O ' ' HG ' ' A' ' 129' ' ' LEU . 8.2 tp -66.87 -40.68 86.33 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.553 -179.561 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 84.6 t80 -63.41 -42.88 98.77 Favored 'General case' 0 C--O 1.232 0.175 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 176.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 93.3 mt -64.32 -29.4 70.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.222 176.601 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -71.14 -29.67 65.52 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.934 177.159 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.516 ' HG ' ' O ' ' A' ' 125' ' ' ILE . 69.6 mt -75.19 -25.41 58.22 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.136 176.197 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.533 0.298 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.417 -179.08 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . 0.449 ' CG2' ' HB3' ' A' ' 7' ' ' GLU . 9.1 p . . . . . 0 C--O 1.233 0.193 0 CA-C-O 120.782 0.325 . . . . 0.0 111.326 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 35.4 t -88.15 148.13 42.15 Favored Pre-proline 0 CA--C 1.534 0.344 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.809 177.359 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_exo -45.41 -33.76 9.57 Favored 'Trans proline' 0 C--N 1.357 0.984 0 C-N-CA 123.003 2.468 . . . . 0.0 112.772 178.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.441 ' O ' HG21 ' A' ' 9' ' ' VAL . 12.6 mm-40 -53.91 -65.01 0.64 Allowed 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.193 0.52 . . . . 0.0 110.734 177.058 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.449 ' HB3' ' CG2' ' A' ' 3' ' ' VAL . 8.1 tp10 -64.57 -33.21 75.39 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.095 -178.372 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.23 -48.24 82.34 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.496 -179.025 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.528 HG23 ' HD2' ' A' ' 10' ' ' LYS . 31.8 m -69.25 -28.52 39.03 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 C-N-CA 120.914 -0.314 . . . . 0.0 110.571 179.781 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.544 ' HA ' ' HG2' ' A' ' 13' ' ' GLU . 3.1 mptp? -68.59 -29.57 68.13 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.644 0.259 . . . . 0.0 110.689 175.649 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 50.7 m0 -63.89 -32.41 73.92 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 170.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -79.92 0.95 81.29 Favored Glycine 0 C--N 1.331 0.304 0 CA-C-N 115.362 -0.836 . . . . 0.0 113.099 -177.602 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.544 ' HG2' ' HA ' ' A' ' 10' ' ' LYS . 11.2 pt-20 -130.65 0.86 4.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.857 0.36 . . . . 0.0 110.418 177.236 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.1 m -152.46 99.02 2.44 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.494 -179.004 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -59.48 -36.01 75.2 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.141 0.496 . . . . 0.0 109.765 178.034 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -57.21 -38.31 73.52 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.277 176.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.71 ' HB2' ' HZ3' ' A' ' 17' ' ' LYS . 1.0 OUTLIER -75.69 -30.09 59.22 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.245 -0.888 . . . . 0.0 110.184 -173.37 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 65.8 tp -59.85 -47.2 86.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.68 173.334 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 7.5 mp -77.14 -25.37 51.95 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.987 178.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 42.8 t -62.45 -29.63 70.66 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.388 178.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -95.13 129.8 42.1 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.106 176.142 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.629 HH11 ' HB2' ' A' ' 26' ' ' GLU . 2.1 tmt_? -58.27 -33.46 69.44 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 176.557 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -61.85 -52.71 63.03 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.986 177.225 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -63.36 -37.8 95.41 Favored Glycine 0 C--N 1.334 0.419 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.89 -179.298 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 16.1 tp -54.16 -58.09 8.67 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.096 0.474 . . . . 0.0 110.481 175.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.629 ' HB2' HH11 ' A' ' 22' ' ' ARG . 15.6 tp10 -65.65 -40.8 92.86 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.534 -176.272 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.414 ' O ' ' HG3' ' A' ' 30' ' ' ARG . . . -61.14 -45.77 93.28 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-O 121.008 0.433 . . . . 0.0 110.71 179.072 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -70.92 -41.11 71.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.899 -177.49 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.506 HG22 ' HA ' ' A' ' 26' ' ' GLU . 14.9 t -69.93 -42.74 72.87 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 120.816 -0.354 . . . . 0.0 110.701 -177.917 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.45 ' NH1' HD13 ' A' ' 125' ' ' ILE . 0.0 OUTLIER -63.58 -27.32 69.17 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.037 0.446 . . . . 0.0 109.811 179.245 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.557 ' O ' HG22 ' A' ' 34' ' ' THR . 93.8 t80 -77.12 -44.3 30.92 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.701 -0.682 . . . . 0.0 109.802 174.068 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.405 HD22 ' HA ' ' A' ' 38' ' ' GLU . 22.9 tp -69.82 -16.63 63.31 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.789 -176.426 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.516 ' HG2' ' HG2' ' A' ' 38' ' ' GLU . 98.2 mttt -81.94 -18.21 44.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.492 179.294 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.557 HG22 ' O ' ' A' ' 31' ' ' PHE . 2.5 t -72.03 -28.48 63.39 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 121.286 0.565 . . . . 0.0 109.613 178.923 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -102.15 -1.64 31.01 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.283 176.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 94.5 m-85 52.63 67.66 0.95 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.373 -179.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 29.5 t -132.42 12.17 4.54 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.926 177.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.516 ' HG2' ' HG2' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -63.78 -18.0 63.64 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.969 179.364 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.42 ' HG3' ' N ' ' A' ' 40' ' ' ASN . 7.5 pt-20 -43.56 -42.5 5.08 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.027 171.775 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . 0.489 ' HB3' HG12 ' A' ' 108' ' ' VAL . 57.1 m-80 -64.02 -46.45 84.42 Favored 'General case' 0 C--O 1.243 0.713 0 CA-C-N 115.329 -0.851 . . . . 0.0 111.404 -175.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.451 ' O ' HG13 ' A' ' 45' ' ' ILE . 32.4 mt -60.77 -51.75 69.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.171 179.831 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -64.57 -24.32 67.56 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.293 178.155 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.466 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 84.2 t80 -58.32 -60.98 2.92 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.711 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 6.7 p-90 -75.88 -17.73 59.68 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 119.762 -0.775 . . . . 0.0 111.854 -178.537 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.451 HG13 ' O ' ' A' ' 41' ' ' ILE . 33.6 mt -60.76 -47.04 94.9 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 170.578 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.41 -34.75 79.04 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.634 178.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.762 ' SG ' ' HB2' ' A' ' 101' ' ' PHE . 49.8 t -60.95 -41.68 96.78 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.507 178.831 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -71.53 -31.09 66.66 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 121.131 0.491 . . . . 0.0 109.997 179.136 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.772 ' HA ' ' HE2' ' A' ' 52' ' ' LYS . 77.8 m-20 -66.08 -32.12 73.4 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 121.308 0.575 . . . . 0.0 109.748 174.702 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 43.3 t80 -70.0 -35.53 74.44 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.455 176.212 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 6.1 tmtm? -58.9 -35.66 73.41 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.697 175.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.772 ' HE2' ' HA ' ' A' ' 49' ' ' ASP . 1.9 mppt? -58.25 -47.7 82.73 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.022 175.481 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 6.2 p -74.52 79.66 1.95 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.199 0.523 . . . . 0.0 110.627 -178.451 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.63 11.32 9.11 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 115.438 -0.801 . . . . 0.0 112.525 -176.299 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . 0.528 ' O ' HG12 ' A' ' 59' ' ' ILE . . . -69.3 126.61 19.77 Favored Glycine 0 CA--C 1.52 0.383 0 C-N-CA 120.81 -0.709 . . . . 0.0 111.521 177.344 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -52.84 -47.75 25.73 Favored 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 122.734 2.29 . . . . 0.0 113.081 -174.169 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 69.4 mt-30 -75.22 -40.85 58.76 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 178.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.537 ' O ' ' HB2' ' A' ' 62' ' ' LYS . 27.8 tp60 -51.17 -39.19 55.82 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 114.858 -1.065 . . . . 0.0 110.704 178.933 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.528 HG12 ' O ' ' A' ' 55' ' ' GLY . 29.6 mm -50.59 -48.41 26.85 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.596 179.527 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 46.2 m-70 -68.07 -54.23 19.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.994 -173.026 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.471 HD12 HE22 ' A' ' 58' ' ' GLN . 3.7 pp -69.42 -25.81 64.31 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.084 -176.704 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.537 ' HB2' ' O ' ' A' ' 58' ' ' GLN . 2.0 tmtm? -70.21 -45.73 66.0 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 175.473 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.51 -32.66 71.67 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.545 177.11 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . 0.407 ' O ' ' HB3' ' A' ' 67' ' ' TYR . 16.2 tppt? -58.94 -46.93 86.81 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.952 0.406 . . . . 0.0 110.267 174.921 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.23 -43.77 98.34 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.599 179.067 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 64.0 mt -68.76 -29.46 43.71 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.312 178.072 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.559 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 92.0 t80 -61.65 -63.83 1.14 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.325 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -61.22 -37.07 81.7 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.711 -175.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -83.46 -37.91 22.54 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -173.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -120.67 -50.14 2.21 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -171.506 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.559 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 49.2 mm -71.67 -31.08 40.68 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 CA-C-O 120.49 0.185 . . . . 0.0 111.36 -169.176 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 12.2 mm-40 -58.15 145.64 36.27 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.168 0.509 . . . . 0.0 111.233 178.513 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 27.7 m -77.47 -45.95 24.05 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 169.756 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -85.49 60.79 6.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.569 172.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.556 ' HB1' ' HA ' ' A' ' 78' ' ' GLU . . . -97.76 161.18 26.6 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.315 -178.685 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_exo -49.6 -53.25 7.35 Favored 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 122.798 2.332 . . . . 0.0 112.745 179.216 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.518 ' HD3' ' O ' ' A' ' 77' ' ' LYS . 1.4 tmtp? -108.99 -23.25 11.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.01 -179.126 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.556 ' HA ' ' HB1' ' A' ' 75' ' ' ALA . 36.4 mt-10 70.4 156.38 0.15 Allowed 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.435 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 50.7 t -130.5 133.09 64.18 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.643 176.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 35.9 m-80 -79.48 20.49 0.55 Allowed 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 122.617 0.367 . . . . 0.0 111.869 -176.326 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.404 HD11 HG21 ' A' ' 108' ' ' VAL . 14.1 tp -62.93 147.42 50.44 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.899 176.814 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -46.57 126.34 8.17 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.852 178.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.533 ' HA ' ' HD3' ' A' ' 86' ' ' LYS . 87.1 t80 -57.02 -39.58 75.04 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.181 -178.368 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 83.2 t60 -66.01 -29.74 70.16 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.714 0.292 . . . . 0.0 110.834 -178.266 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 56.8 m -71.43 -46.66 59.52 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 175.454 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.558 ' O ' HG22 ' A' ' 90' ' ' THR . 26.1 mtpp -55.99 -41.49 74.92 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.584 175.223 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -52.9 -59.72 4.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 114.887 -1.051 . . . . 0.0 111.107 -179.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 61.3 t -56.49 -40.71 69.57 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.908 -178.104 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 75.2 mt -66.92 -47.7 81.73 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.19 -178.113 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.558 HG22 ' O ' ' A' ' 86' ' ' LYS . 82.8 p -59.8 -31.27 69.55 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 120.922 0.392 . . . . 0.0 111.117 -176.694 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -85.13 -24.5 27.98 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.99 -179.784 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 32.3 t -97.0 2.14 51.11 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.802 -179.647 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.5 tp -53.3 -29.98 16.79 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.819 -177.156 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 8.8 t -61.85 -38.39 88.06 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.955 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -141.91 81.0 15.0 Favored Pre-proline 0 N--CA 1.464 0.259 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.502 -179.652 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . 0.434 ' HG2' HG22 ' A' ' 59' ' ' ILE . 93.2 Cg_endo -86.62 143.33 7.26 Favored 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 122.662 2.241 . . . . 0.0 111.706 176.566 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' THR . . . . . 0.402 ' H ' ' HB3' ' A' ' 100' ' ' SER . 36.7 p -79.39 171.55 15.01 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.135 177.559 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 36.2 tp -57.54 -30.63 65.36 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.61 -174.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' HIS . . . . . 0.413 ' O ' ' HB2' ' A' ' 102' ' ' ASP . 0.1 OUTLIER -132.63 43.55 2.97 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 177.939 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' SER . . . . . 0.402 ' HB3' ' H ' ' A' ' 97' ' ' THR . 6.3 p -53.12 -33.47 52.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.428 -0.806 . . . . 0.0 112.076 -178.723 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.762 ' HB2' ' SG ' ' A' ' 47' ' ' CYS . 38.7 m-85 -83.2 9.38 10.74 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.223 -176.807 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . 0.413 ' HB2' ' O ' ' A' ' 99' ' ' HIS . 19.0 t70 -56.94 -44.75 82.84 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 121.009 0.433 . . . . 0.0 110.966 -176.371 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.01 -31.98 71.58 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.57 178.078 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.46 -37.03 84.23 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.498 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -54.57 -41.68 70.13 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 120.826 0.346 . . . . 0.0 110.288 176.209 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 49.0 m -62.24 -53.37 56.13 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.592 -179.269 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 39.5 mmt-85 -57.49 -48.97 77.8 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.239 -179.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.489 HG12 ' HB3' ' A' ' 40' ' ' ASN . 71.2 t -64.29 -52.52 54.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.863 -176.027 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -56.11 -53.74 53.37 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.462 -176.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.1 -31.02 71.21 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.834 -175.043 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 54.4 tp -65.24 -47.97 74.92 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.506 -179.224 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 62.8 mtm -62.33 -39.35 92.78 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.176 0.512 . . . . 0.0 110.146 178.133 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . 0.608 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 38.4 tt0 -58.93 -62.5 1.83 Allowed 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.302 -175.848 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -54.4 -31.56 55.24 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 -169.338 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -105.28 -63.21 1.26 Allowed 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 112.085 0.402 . . . . 0.0 112.085 -175.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 22.5 t -70.52 -42.3 71.44 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.686 0.279 . . . . 0.0 111.101 -173.52 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . 0.608 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 28.3 t80 -67.48 -35.77 79.82 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.725 -0.216 . . . . 0.0 111.321 -175.495 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 29.8 p -65.45 -49.54 68.77 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-O 120.856 0.36 . . . . 0.0 110.366 178.538 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 38.4 ttt180 -62.54 -34.33 76.71 Favored 'General case' 0 C--O 1.225 -0.201 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 176.127 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 83.5 t80 -61.35 -33.85 74.32 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.198 177.223 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.491 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 81.5 mt -68.96 -24.74 64.29 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.767 0.317 . . . . 0.0 110.737 177.117 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 17.7 tptt -113.39 15.08 19.24 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 120.963 -0.295 . . . . 0.0 111.576 177.53 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 92.5 p -73.14 157.92 36.29 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.637 0.256 . . . . 0.0 110.53 -179.506 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -55.17 -28.32 52.02 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.041 0.448 . . . . 0.0 110.067 175.362 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.45 HD13 ' NH1' ' A' ' 30' ' ' ARG . 58.9 mt -62.43 -56.75 15.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.452 177.148 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' TYR . . . . . 0.497 ' OH ' ' HA ' ' A' ' 9' ' ' VAL . 32.0 t80 -70.21 -39.37 75.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.555 -175.004 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 98.5 mt -60.72 -32.28 71.55 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 121.099 0.476 . . . . 0.0 110.062 177.022 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -66.82 -36.84 83.29 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.231 177.053 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 72.4 mt -74.25 -29.26 61.6 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.753 177.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' MET . . . . . 0.668 ' HE2' ' HA ' ' A' ' 130' ' ' MET . 21.3 mmt . . . . . 0 N--CA 1.467 0.417 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.425 -177.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 2.6 p . . . . . 0 CA--C 1.53 0.187 0 CA-C-O 121.189 0.519 . . . . 0.0 111.151 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.6 m -119.75 162.37 33.2 Favored Pre-proline 0 CA--C 1.534 0.333 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.39 178.335 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo -41.83 -48.53 5.92 Favored 'Trans proline' 0 C--N 1.356 0.921 0 C-N-CA 123.16 2.574 . . . . 0.0 113.339 -179.802 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.629 ' O ' ' HG2' ' A' ' 10' ' ' LYS . 49.9 mt-10 -62.81 -40.81 98.51 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 120.749 0.309 . . . . 0.0 110.978 179.765 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 15.4 tp10 -63.47 -36.41 83.65 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.185 0.517 . . . . 0.0 109.729 177.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.08 -41.0 91.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.263 -179.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.543 HG23 ' O ' ' A' ' 6' ' ' GLU . 16.3 m -69.97 -25.11 27.27 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.239 0 C-N-CA 120.797 -0.361 . . . . 0.0 110.42 179.918 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.629 ' HG2' ' O ' ' A' ' 6' ' ' GLU . 74.6 mmtt -64.12 -32.22 73.7 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 121.377 0.608 . . . . 0.0 109.667 175.199 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 31.4 m0 -79.36 -33.49 42.89 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.437 176.594 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -72.38 -0.49 46.71 Favored Glycine 0 C--N 1.334 0.441 0 CA-C-N 115.308 -0.86 . . . . 0.0 112.975 -179.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -115.51 -4.66 12.26 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.848 0.324 . . . . 0.0 110.889 176.506 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 43.7 t -165.32 111.05 0.92 Allowed 'General case' 0 C--O 1.234 0.264 0 CA-C-O 120.862 0.363 . . . . 0.0 111.247 -177.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 41.4 t80 -63.15 -32.95 74.46 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 174.381 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -58.75 -39.44 80.95 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.034 -0.984 . . . . 0.0 110.588 174.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.467 ' HD2' ' O ' ' A' ' 10' ' ' LYS . 38.8 ttmt -76.27 -33.86 59.12 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.402 -179.878 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 53.4 tp -55.76 -46.62 77.84 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 121.203 0.525 . . . . 0.0 110.197 176.16 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.419 HD23 ' CZ2' ' A' ' 44' ' ' TRP . 4.4 mp -76.05 -23.77 55.11 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.851 179.748 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.0 t -70.97 -25.73 62.84 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.927 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -97.8 123.53 41.8 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 69.4 mtp180 -52.66 -39.47 61.87 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 120.738 0.304 . . . . 0.0 110.859 -179.147 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -54.84 -47.25 74.38 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.683 -0.69 . . . . 0.0 109.996 177.613 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -71.21 -40.23 61.49 Favored Glycine 0 N--CA 1.45 -0.367 0 CA-C-N 115.385 -0.825 . . . . 0.0 112.0 -179.119 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.404 ' O ' HG21 ' A' ' 29' ' ' THR . 10.0 tt -58.66 -47.99 82.58 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 178.635 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -57.42 -57.14 13.95 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.333 178.331 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -58.38 -40.81 83.34 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.361 -177.346 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 93.2 t80 -74.31 -40.99 61.87 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.722 -175.572 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.628 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 11.7 t -72.54 -41.12 66.15 Favored 'General case' 0 CA--C 1.515 -0.39 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 -175.893 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 11.0 ttm180 -56.18 -42.16 76.64 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.167 173.433 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.469 ' O ' HG22 ' A' ' 34' ' ' THR . 89.1 t80 -67.46 -28.98 68.32 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.993 179.063 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 32.4 tp -86.58 -27.61 23.8 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 121.062 0.458 . . . . 0.0 110.869 -178.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.628 ' HG3' ' O ' ' A' ' 29' ' ' THR . 68.3 mttm -72.57 -17.93 61.66 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.874 179.807 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.469 HG22 ' O ' ' A' ' 31' ' ' PHE . 4.3 t -62.15 -27.25 68.81 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 120.915 0.388 . . . . 0.0 110.471 179.351 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -111.55 5.83 19.7 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.759 179.655 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 63.05 24.49 14.53 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 115.782 -0.645 . . . . 0.0 112.36 176.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 28.5 m -97.19 19.23 13.36 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.298 0.57 . . . . 0.0 110.279 177.246 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.504 ' HB3' ' HG2' ' A' ' 33' ' ' LYS . 11.8 pt-20 -62.14 -24.96 67.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.24 -0.891 . . . . 0.0 112.332 -173.604 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.424 ' O ' ' HB2' ' A' ' 43' ' ' PHE . 11.3 mp0 -51.61 -22.3 3.22 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -176.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . 0.56 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 47.4 m-80 -71.65 -60.84 2.02 Favored 'General case' 0 C--O 1.242 0.676 0 CA-C-O 121.115 0.483 . . . . 0.0 110.901 -179.738 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.46 ' O ' HG13 ' A' ' 45' ' ' ILE . 8.4 tt -62.69 -41.02 90.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 179.37 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.452 ' OE1' ' HB2' ' A' ' 38' ' ' GLU . 0.9 OUTLIER -64.74 -27.0 68.61 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.068 176.227 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.56 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 77.6 t80 -58.85 -59.03 6.1 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 120.703 0.287 . . . . 0.0 110.536 178.061 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.421 ' HB2' ' HG2' ' A' ' 105' ' ' GLN . 28.5 p-90 -74.34 -14.79 60.93 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 119.377 -0.929 . . . . 0.0 111.665 -177.162 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.46 HG13 ' O ' ' A' ' 41' ' ' ILE . 68.2 mt -71.16 -37.3 66.03 Favored 'Isoleucine or valine' 0 C--O 1.238 0.461 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 169.231 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.59 -27.04 68.68 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.961 175.473 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.424 ' SG ' ' HB2' ' A' ' 101' ' ' PHE . 53.1 t -62.44 -29.05 70.23 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.038 175.258 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.489 ' O ' ' HG2' ' A' ' 51' ' ' LYS . 19.1 mt-10 -72.31 -41.0 67.07 Favored 'General case' 0 N--CA 1.458 -0.058 0 N-CA-C 109.784 -0.451 . . . . 0.0 109.784 174.397 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -61.36 -26.38 67.79 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.025 0.44 . . . . 0.0 110.377 174.075 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -73.95 -46.14 45.89 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.984 177.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.489 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 64.3 pttt -70.2 -23.1 62.89 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 116.759 -0.2 . . . . 0.0 111.422 -175.459 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.477 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 19.3 ptmt -90.37 7.96 35.95 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -177.367 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 65.9 m -54.54 119.16 4.86 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 120.807 0.337 . . . . 0.0 110.443 178.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.14 -19.45 65.6 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.782 -175.673 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -125.4 148.47 16.88 Favored Glycine 0 C--N 1.331 0.304 0 C-N-CA 120.95 -0.643 . . . . 0.0 112.402 -177.231 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -67.93 -32.55 28.55 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.683 2.255 . . . . 0.0 111.987 -179.082 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -71.66 -34.48 69.77 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 177.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 56.6 tp60 -58.7 -32.45 69.18 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.123 178.745 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.475 HG23 ' HG2' ' A' ' 96' ' ' PRO . 33.9 mm -55.23 -45.44 77.54 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.496 175.668 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 40.5 m-70 -66.19 -40.92 90.76 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.115 -178.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 77.6 mt -63.91 -49.99 70.49 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.02 -178.599 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.527 ' HA ' ' HE2' ' A' ' 62' ' ' LYS . 9.0 mmpt? -65.55 -42.98 91.26 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.833 -178.701 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.58 -46.78 86.21 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.804 179.648 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 6.7 tmtt? -63.39 -37.04 85.72 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.238 179.315 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.16 -51.91 65.93 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.561 179.054 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 72.6 mt -62.38 -36.01 72.51 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.193 178.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.559 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 74.3 t80 -58.48 -63.89 1.12 Allowed 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.489 178.849 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -54.72 -40.12 68.91 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.984 -174.608 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 56.3 tttm -96.41 -16.64 21.11 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 112.478 0.547 . . . . 0.0 112.478 -168.085 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -135.02 -53.37 0.8 Allowed 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 112.705 0.632 . . . . 0.0 112.705 -174.522 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.559 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 48.5 mm -67.41 -41.69 86.48 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 CA-C-O 120.618 0.247 . . . . 0.0 111.401 -170.047 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 51.2 tp60 -50.69 131.46 25.66 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.509 -178.358 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 20.4 m -54.82 -31.49 59.25 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.808 -174.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -114.9 32.52 5.97 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.049 0.452 . . . . 0.0 110.749 -178.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.53 ' HB1' ' HA ' ' A' ' 78' ' ' GLU . . . -60.44 158.61 28.53 Favored Pre-proline 0 CA--C 1.537 0.481 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.056 179.108 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.492 ' HD2' ' HB3' ' A' ' 75' ' ' ALA . 2.0 Cg_endo -44.05 -54.31 3.96 Favored 'Trans proline' 0 C--N 1.358 1.031 0 C-N-CA 123.672 2.915 . . . . 0.0 113.458 -175.579 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 43.2 mtpt -107.16 -19.28 13.65 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 110.313 -0.254 . . . . 0.0 110.313 175.16 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.53 ' HA ' ' HB1' ' A' ' 75' ' ' ALA . 10.0 pt-20 52.89 162.84 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.969 1.308 . . . . 0.0 113.282 -179.855 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.418 ' C ' ' H ' ' A' ' 81' ' ' LEU . 64.5 t -126.87 137.57 57.46 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 CA-C-N 114.856 -1.066 . . . . 0.0 108.835 174.572 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.402 ' HB2' HD22 ' A' ' 111' ' ' LEU . 17.6 m120 -74.63 20.56 0.12 Allowed 'General case' 0 N--CA 1.469 0.513 0 O-C-N 123.272 0.358 . . . . 0.0 111.851 -176.34 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.418 ' H ' ' C ' ' A' ' 79' ' ' VAL . 61.9 tp -50.07 134.42 21.93 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.487 175.034 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -47.43 140.59 5.6 Favored 'General case' 0 N--CA 1.469 0.475 0 O-C-N 123.475 0.484 . . . . 0.0 111.974 -177.744 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 99.1 m-85 -58.25 -48.27 80.97 Favored 'General case' 0 C--N 1.333 -0.109 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.705 -177.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 83.1 t60 -59.89 -37.31 79.02 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.048 -179.478 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 25.8 m -67.88 -49.94 59.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.872 -178.547 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.518 ' O ' HG23 ' A' ' 90' ' ' THR . 17.9 ptpt -72.55 -21.33 61.18 Favored 'General case' 0 C--O 1.227 -0.112 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.451 179.278 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 14.4 tp10 -57.89 -55.23 37.52 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 173.641 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 59.7 t -52.84 -49.37 47.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.926 176.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 68.3 mt -58.27 -44.14 87.49 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.853 -177.822 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.518 HG23 ' O ' ' A' ' 86' ' ' LYS . 64.2 p -61.28 -29.21 69.72 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 120.791 0.329 . . . . 0.0 110.824 -177.618 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 56.5 m-80 -88.51 -37.81 15.46 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.669 179.678 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 61.9 p -100.53 11.45 39.44 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 112.011 0.375 . . . . 0.0 112.011 -174.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.3 tp -58.37 -24.58 25.17 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 CA-C-O 120.984 0.421 . . . . 0.0 111.391 -178.457 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 8.8 t -76.45 -15.78 59.83 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.588 -179.199 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 16.3 pt20 -135.41 58.69 27.18 Favored Pre-proline 0 CA--C 1.538 0.496 0 CA-C-O 120.903 0.382 . . . . 0.0 110.979 -177.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . 0.475 ' HG2' HG23 ' A' ' 59' ' ' ILE . 85.3 Cg_endo -81.62 122.47 4.0 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.656 2.237 . . . . 0.0 112.401 -176.309 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 11.5 m -71.42 161.7 30.62 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.197 177.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -51.21 -38.74 54.09 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 122.502 0.321 . . . . 0.0 111.654 -177.611 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 28.7 m-70 -113.21 38.88 2.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.075 0.464 . . . . 0.0 110.884 178.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 17.2 p -62.29 -53.07 60.48 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.254 0.55 . . . . 0.0 110.476 177.031 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.424 ' HB2' ' SG ' ' A' ' 47' ' ' CYS . 94.8 m-85 -74.11 -0.98 18.27 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.358 -179.801 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . 0.489 ' O ' ' HB3' ' A' ' 105' ' ' GLN . 14.6 t70 -61.71 -33.25 73.69 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.13 0.49 . . . . 0.0 109.966 178.621 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.29 -41.57 96.82 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.896 174.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.94 -29.6 69.51 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.198 177.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.489 ' HB3' ' O ' ' A' ' 102' ' ' ASP . 21.7 tm0? -56.03 -52.29 64.77 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.922 177.005 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 31.5 t -62.06 -38.47 88.92 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.559 179.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 6.2 mmp_? -61.3 -54.43 44.05 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.951 179.315 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 96.8 t -64.56 -36.63 77.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 121.309 0.576 . . . . 0.0 110.369 -179.31 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -55.99 -50.57 70.46 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.737 176.477 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -73.76 -29.21 62.08 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 120.821 0.344 . . . . 0.0 110.551 -179.205 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.427 ' O ' ' HG2' ' A' ' 114' ' ' GLN . 57.0 tp -62.85 -43.52 98.58 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.494 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 58.8 mtm -75.63 -35.44 60.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.052 177.41 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . 0.424 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 3.7 tm-20 -52.31 -53.46 44.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.938 -177.811 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . 0.427 ' HG2' ' O ' ' A' ' 111' ' ' LEU . 4.3 pt20 -54.29 -17.04 2.52 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 112.732 0.641 . . . . 0.0 112.732 -172.831 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 42.4 m-20 -124.88 -68.16 0.87 Allowed 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.225 0.536 . . . . 0.0 110.795 178.515 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 5.0 m -59.09 -29.7 67.55 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.422 -0.808 . . . . 0.0 112.455 -171.309 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . 0.424 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 19.6 t80 -65.87 -59.07 4.22 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 120.55 0.214 . . . . 0.0 110.93 -177.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 1.3 p -60.97 -38.35 85.65 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.657 0.265 . . . . 0.0 110.926 179.278 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 78.9 mtp85 -58.15 -42.31 85.62 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.001 0.429 . . . . 0.0 110.01 175.194 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -64.14 -38.99 93.03 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.416 178.045 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 92.8 mt -66.76 -21.62 66.05 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.232 -179.217 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? -108.75 -0.94 19.72 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 120.662 0.268 . . . . 0.0 111.488 179.442 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 80.4 p -66.3 152.69 44.42 Favored 'General case' 0 C--O 1.237 0.407 0 O-C-N 122.256 -0.277 . . . . 0.0 110.519 179.613 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -54.47 -31.88 56.61 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 175.717 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.547 ' O ' ' HG ' ' A' ' 129' ' ' LEU . 72.9 mt -55.66 -59.06 2.96 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.174 0 CA-C-N 115.177 -0.919 . . . . 0.0 110.678 178.518 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 58.4 t80 -59.53 -43.94 93.33 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.021 -174.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -66.44 -31.55 72.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.794 179.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -71.04 -35.41 71.96 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.015 177.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.547 ' HG ' ' O ' ' A' ' 125' ' ' ILE . 47.8 mt -59.88 -40.46 88.77 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.915 178.358 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' MET . . . . . . . . . . . . . 23.5 mmt . . . . . 0 C--O 1.234 0.289 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.835 175.924 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . 0.614 HG12 HD11 ' A' ' 129' ' ' LEU . 2.9 p . . . . . 0 CA--C 1.531 0.25 0 CA-C-O 121.359 0.599 . . . . 0.0 111.792 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.41 ' OG ' ' HD2' ' A' ' 5' ' ' PRO . 47.1 t -100.24 156.58 35.11 Favored Pre-proline 0 C--N 1.326 -0.415 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 170.817 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.41 ' HD2' ' OG ' ' A' ' 4' ' ' SER . 72.3 Cg_exo -42.62 -37.88 5.9 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 122.519 2.146 . . . . 0.0 112.73 176.8 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.529 ' O ' HG23 ' A' ' 9' ' ' VAL . 7.0 mm-40 -67.4 -43.12 82.06 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 121.603 0.716 . . . . 0.0 110.16 176.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.515 ' HB3' HG21 ' A' ' 3' ' ' VAL . 14.8 tp10 -67.46 -23.31 65.49 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.379 -0.828 . . . . 0.0 109.973 178.922 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.475 ' HB1' ' HE2' ' A' ' 130' ' ' MET . . . -73.9 -47.22 39.45 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.792 178.644 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.529 HG23 ' O ' ' A' ' 6' ' ' GLU . 19.3 m -63.42 -24.13 35.09 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 C-N-CA 121.091 -0.244 . . . . 0.0 110.527 179.745 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.501 ' O ' ' HD2' ' A' ' 17' ' ' LYS . 32.6 mmtp -51.99 -46.91 65.06 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 121.343 0.592 . . . . 0.0 110.224 172.175 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 33.5 m0 -64.51 -28.22 69.51 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.563 -176.163 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -74.62 -11.04 83.12 Favored Glycine 0 N--CA 1.452 -0.256 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.401 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -80.98 -24.77 37.79 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 120.831 0.348 . . . . 0.0 110.543 179.112 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 45.8 t -172.57 131.88 0.57 Allowed 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.661 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -61.52 -25.5 67.32 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.649 174.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -68.65 -35.71 77.62 Favored 'General case' 0 N--CA 1.461 0.114 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.007 176.129 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.501 ' HD2' ' O ' ' A' ' 10' ' ' LYS . 35.6 ttmt -70.25 -36.92 74.78 Favored 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 115.998 -0.546 . . . . 0.0 109.928 179.313 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 48.8 tp -58.43 -45.89 87.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.201 174.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.7 mp -74.78 -30.64 61.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.932 -177.311 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.466 ' HG ' ' HA ' ' A' ' 17' ' ' LYS . 69.7 p -78.35 -27.19 46.95 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 120.945 0.402 . . . . 0.0 110.364 178.787 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 24.0 t-80 -72.75 110.3 6.98 Favored 'General case' 0 C--O 1.221 -0.4 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 176.305 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.18 -53.49 16.67 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 121.2 0.524 . . . . 0.0 111.019 -175.238 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -68.81 -20.66 64.33 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.827 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -78.56 -53.41 4.68 Favored Glycine 0 C--N 1.332 0.329 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.795 -179.461 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.9 tt -51.71 -38.4 54.99 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 123.223 0.609 . . . . 0.0 110.682 174.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.624 ' O ' ' HG2' ' A' ' 30' ' ' ARG . 10.5 tp10 -62.35 -53.67 51.65 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.88 176.847 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -55.37 -44.97 76.55 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-O 121.293 0.568 . . . . 0.0 110.932 179.772 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . 0.406 ' CE2' HD23 ' A' ' 32' ' ' LEU . 75.3 t80 -64.2 -44.14 92.89 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.872 -179.274 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.579 HG22 ' O ' ' A' ' 26' ' ' GLU . 4.0 t -67.01 -27.79 67.71 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.067 -177.941 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.624 ' HG2' ' O ' ' A' ' 26' ' ' GLU . 35.0 mmt180 -54.95 -52.89 61.6 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 173.305 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.551 ' O ' HG23 ' A' ' 34' ' ' THR . 84.3 t80 -68.21 -45.59 72.94 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.945 -179.141 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.406 HD23 ' CE2' ' A' ' 28' ' ' PHE . 21.5 tp -63.56 -29.85 71.04 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.003 0.43 . . . . 0.0 111.179 -175.344 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.423 ' HE2' ' OG1' ' A' ' 29' ' ' THR . 67.6 mttm -80.75 -9.69 59.78 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.559 179.295 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.551 HG23 ' O ' ' A' ' 31' ' ' PHE . 0.7 OUTLIER -84.13 -28.28 27.56 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 177.955 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -98.41 4.67 48.47 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.716 178.113 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 87.1 m-85 65.16 18.01 11.27 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.811 176.051 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 25.5 m -97.21 15.01 23.97 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 121.045 0.45 . . . . 0.0 110.641 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -56.08 -24.23 38.77 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.338 -179.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -45.62 -43.6 12.43 Favored 'General case' 0 C--O 1.225 -0.203 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.628 176.7 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . 0.507 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 2.0 m-20 -57.67 -59.24 5.5 Favored 'General case' 0 C--O 1.245 0.837 0 CA-C-O 121.448 0.642 . . . . 0.0 112.007 -175.288 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.479 ' O ' HG13 ' A' ' 45' ' ' ILE . 13.2 tt -61.64 -42.4 94.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.043 -175.807 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.445 ' HA ' ' HB ' ' A' ' 45' ' ' ILE . 49.3 mt-10 -78.96 -10.01 59.69 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.069 -178.943 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.507 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 72.5 t80 -67.73 -59.28 3.44 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 175.311 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.438 ' HA ' ' SG ' ' A' ' 47' ' ' CYS . 32.1 p-90 -76.06 -19.01 58.97 Favored 'General case' 0 N--CA 1.463 0.215 0 C-N-CA 119.887 -0.725 . . . . 0.0 111.414 -178.861 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.479 HG13 ' O ' ' A' ' 41' ' ' ILE . 54.7 mt -62.92 -39.53 85.43 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 169.901 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.24 -35.64 81.67 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.214 175.408 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.438 ' SG ' ' HA ' ' A' ' 44' ' ' TRP . 67.4 m -63.94 -33.55 75.97 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.32 177.03 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.647 ' O ' ' HG2' ' A' ' 51' ' ' LYS . 9.0 mm-40 -66.72 -52.89 39.29 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 173.4 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -53.31 -26.31 18.22 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.349 0.595 . . . . 0.0 110.325 178.265 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.409 ' HD1' ' HD3' ' A' ' 62' ' ' LYS . 41.8 t80 -74.28 -40.3 62.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.334 177.48 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.647 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 59.9 pttt -66.94 -18.13 65.24 Favored 'General case' 0 N--CA 1.471 0.591 0 O-C-N 121.993 -0.442 . . . . 0.0 110.777 -178.302 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -72.7 -27.3 61.99 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.859 177.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 67.1 p -59.73 124.04 18.87 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 121.092 0.472 . . . . 0.0 110.419 -177.374 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.98 -14.23 16.03 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.752 -177.892 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -83.39 119.39 4.88 Favored Glycine 0 N--CA 1.448 -0.505 0 CA-C-N 115.934 -0.576 . . . . 0.0 112.03 -179.082 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_exo -53.15 -33.54 64.68 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.86 2.373 . . . . 0.0 112.014 179.062 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 20.3 mp0 -71.67 -39.66 70.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.614 178.495 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 55.4 tp60 -61.83 -40.55 95.66 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.26 -178.341 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 44.4 mm -49.53 -51.35 15.12 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.248 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.972 -178.853 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 79.2 m-70 -64.43 -55.1 23.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.692 -0.686 . . . . 0.0 111.688 -175.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.491 HD13 ' N ' ' A' ' 62' ' ' LYS . 4.3 pp -71.22 -30.16 66.01 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.805 -173.277 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.491 ' N ' HD13 ' A' ' 61' ' ' LEU . 57.6 tttp -74.29 -43.4 56.96 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 -179.88 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.33 -36.05 82.41 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.252 176.033 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 6.7 tmtt? -63.18 -36.76 84.71 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 115.659 -0.7 . . . . 0.0 109.971 179.026 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -66.87 -55.42 14.84 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.482 177.585 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 66.9 mt -56.31 -35.68 43.93 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-O 121.365 0.602 . . . . 0.0 110.238 178.431 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 76.2 t80 -56.08 -56.85 15.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.071 -0.968 . . . . 0.0 110.52 178.11 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.477 ' HA ' ' HB2' ' A' ' 72' ' ' GLN . 34.3 mt-10 -77.88 -18.22 56.43 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.543 -174.638 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -82.06 -36.73 27.38 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.132 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -126.47 -51.55 1.5 Allowed 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 112.135 0.421 . . . . 0.0 112.135 -174.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 33.7 mm -71.98 -15.51 18.11 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.373 0 CA-C-O 121.063 0.459 . . . . 0.0 111.34 -171.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.477 ' HB2' ' HA ' ' A' ' 68' ' ' GLU . 16.5 tm0? -58.71 132.79 54.92 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.477 179.143 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.9 m -55.05 -37.3 66.55 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 112.613 0.597 . . . . 0.0 112.613 -170.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -84.02 -67.35 0.8 Allowed 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 110.116 -0.327 . . . . 0.0 110.116 179.109 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . 64.06 156.84 0.12 Allowed Pre-proline 0 CA--C 1.539 0.53 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.682 178.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -73.31 -7.29 20.23 Favored 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 122.438 2.092 . . . . 0.0 112.586 -178.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.434 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 46.6 tttm -145.28 7.92 1.18 Allowed 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.591 -177.873 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 38.4 86.24 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.65 0.78 . . . . 0.0 112.266 -174.596 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 54.3 t -56.28 132.91 20.47 Favored 'Isoleucine or valine' 0 C--O 1.232 0.16 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.291 -179.376 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 43.9 m-80 -76.25 14.99 0.63 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 116.232 -0.44 . . . . 0.0 112.178 -173.31 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.457 ' O ' ' NZ ' ' A' ' 86' ' ' LYS . 57.7 tp -62.22 133.81 55.68 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 175.537 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -61.36 167.62 3.15 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-O 121.168 0.509 . . . . 0.0 111.785 -176.356 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 92.9 t80 -69.74 -43.97 71.22 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.162 -177.211 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . 0.46 ' O ' HG22 ' A' ' 88' ' ' VAL . 80.6 t60 -58.83 -51.83 68.32 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.446 -174.887 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 43.7 m -63.7 -42.76 97.93 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.519 -176.001 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.457 ' NZ ' ' O ' ' A' ' 81' ' ' LEU . 8.0 ptpp? -67.31 -33.03 74.42 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 120.586 -0.445 . . . . 0.0 109.984 179.236 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -61.86 -45.53 93.37 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.223 0.535 . . . . 0.0 109.898 177.554 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.46 HG22 ' O ' ' A' ' 84' ' ' HIS . 88.2 t -54.86 -43.14 66.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.976 176.583 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 72.4 mt -65.44 -43.76 94.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.886 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 39.9 p -63.72 -25.05 68.02 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 111.683 0.253 . . . . 0.0 111.683 -176.525 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 60.5 m-80 -90.43 -22.94 21.18 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 120.706 0.289 . . . . 0.0 111.16 177.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 29.3 t -100.24 -5.48 27.51 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.714 -0.221 . . . . 0.0 111.348 -177.373 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 9.9 tp -62.68 -23.55 33.05 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 CA-C-N 116.683 -0.235 . . . . 0.0 111.608 -175.819 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 6.8 t -58.6 -49.42 77.52 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-O 120.737 0.304 . . . . 0.0 110.88 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 21.6 mt-30 -139.43 81.53 20.26 Favored Pre-proline 0 C--O 1.235 0.316 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 178.352 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -83.1 162.5 15.52 Favored 'Trans proline' 0 CA--C 1.532 0.414 0 C-N-CA 122.834 2.356 . . . . 0.0 112.939 -176.281 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 77.1 p -90.35 174.78 7.39 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.119 174.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 9.2 mp -63.72 -11.86 29.66 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 120.828 0.347 . . . . 0.0 111.507 -178.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' HIS . . . . . 0.432 ' O ' ' HB2' ' A' ' 102' ' ' ASP . 0.2 OUTLIER -143.64 37.34 1.33 Allowed 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 -178.386 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 22.9 t -57.28 -22.86 44.53 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.969 -176.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 82.8 m-85 -88.93 15.37 8.62 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.797 0.332 . . . . 0.0 110.616 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . 0.534 ' HA ' ' NE2' ' A' ' 105' ' ' GLN . 20.5 t70 -54.67 -53.12 58.97 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.75 -173.768 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.436 ' O ' ' HG2' ' A' ' 107' ' ' ARG . . . -59.98 -37.51 79.84 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 120.993 0.425 . . . . 0.0 111.002 178.807 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.74 -37.73 85.33 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.012 -178.096 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.534 ' NE2' ' HA ' ' A' ' 102' ' ' ASP . 29.4 mt-30 -54.86 -57.02 13.28 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-O 121.286 0.565 . . . . 0.0 109.587 177.932 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' SER . . . . . 0.671 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 20.0 m -55.94 -45.58 78.77 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 114.735 -1.12 . . . . 0.0 110.828 -176.86 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . 0.491 ' O ' ' HG ' ' A' ' 111' ' ' LEU . 39.8 mmt180 -54.08 -57.97 9.08 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.974 0.416 . . . . 0.0 111.004 -179.56 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.537 ' HA ' HD11 ' A' ' 111' ' ' LEU . 46.3 t -63.17 -33.45 60.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.566 -178.002 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . 0.44 ' HA ' ' HE2' ' A' ' 112' ' ' MET . 48.3 t80 -59.14 -45.33 91.22 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.762 177.655 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . 0.671 ' HG3' ' O ' ' A' ' 106' ' ' SER . 29.7 mt-30 -61.07 -40.92 95.52 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.528 0.68 . . . . 0.0 109.684 178.063 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.537 HD11 ' HA ' ' A' ' 108' ' ' VAL . 94.4 mt -58.04 -54.12 50.5 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.538 -1.21 . . . . 0.0 112.432 -172.296 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' MET . . . . . 0.472 ' HB3' ' ND2' ' A' ' 40' ' ' ASN . 0.0 OUTLIER -85.59 -12.38 51.68 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 119.864 -0.734 . . . . 0.0 110.922 -177.654 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . 0.665 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 38.4 tt0 -63.71 -66.69 0.51 Allowed 'General case' 0 C--O 1.233 0.231 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 174.074 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -50.91 -32.32 20.32 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.676 -177.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . 0.548 ' O ' ' HD3' ' A' ' 119' ' ' ARG . 25.1 t70 -97.84 -76.5 0.52 Allowed 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.612 -176.68 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 23.0 t -62.8 -38.18 89.67 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -171.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . 0.665 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 31.0 t80 -64.98 -38.88 92.42 Favored 'General case' 0 N--CA 1.468 0.454 0 O-C-N 122.287 -0.258 . . . . 0.0 111.157 -176.471 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 27.8 p -67.73 -42.03 82.51 Favored 'General case' 0 C--O 1.24 0.568 0 CA-C-O 121.063 0.459 . . . . 0.0 110.541 179.41 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . 0.548 ' HD3' ' O ' ' A' ' 115' ' ' ASP . 10.5 mpt_? -66.54 -34.84 78.79 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.005 176.267 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 86.3 t80 -60.83 -42.27 97.43 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 175.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 91.3 mt -61.87 -27.82 69.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.607 177.424 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . 0.464 ' HD3' ' HA ' ' A' ' 122' ' ' LYS . 64.0 mmtt -110.03 18.34 20.14 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 112.379 0.511 . . . . 0.0 112.379 179.262 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 80.2 p -79.77 147.72 31.74 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 171.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -55.22 -29.87 58.83 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 121.066 0.46 . . . . 0.0 110.39 176.516 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.443 ' O ' ' HG ' ' A' ' 129' ' ' LEU . 2.1 mp -60.19 -57.72 10.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.482 179.4 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 72.9 t80 -65.52 -39.34 91.71 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.664 -177.486 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -63.77 -33.41 75.59 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.854 178.136 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -67.83 -34.53 76.9 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.065 0.459 . . . . 0.0 110.288 176.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.614 HD11 HG12 ' A' ' 3' ' ' VAL . 73.3 mt -76.41 -17.53 59.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.451 178.159 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' MET . . . . . 0.475 ' HE2' ' HB1' ' A' ' 8' ' ' ALA . 0.0 OUTLIER . . . . . 0 C--N 1.332 -0.172 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.829 178.493 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . 0.466 HG22 ' HB3' ' A' ' 7' ' ' GLU . 4.0 p . . . . . 0 N--CA 1.454 -0.263 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 16.8 m -104.37 150.94 38.99 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 116.245 -0.434 . . . . 0.0 109.938 -179.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo -45.95 -31.78 8.7 Favored 'Trans proline' 0 C--N 1.353 0.797 0 C-N-CA 123.325 2.684 . . . . 0.0 112.667 178.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.445 ' O ' ' HD3' ' A' ' 10' ' ' LYS . 9.1 tp10 -55.74 -52.52 63.63 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-O 121.343 0.592 . . . . 0.0 110.144 175.649 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.466 ' HB3' HG22 ' A' ' 3' ' ' VAL . 9.5 tp10 -69.23 -32.67 72.07 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.727 -0.669 . . . . 0.0 109.967 179.04 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.66 -46.64 87.27 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.073 -179.348 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.404 HG23 ' O ' ' A' ' 6' ' ' GLU . 32.2 m -67.83 -27.93 39.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.313 0 CA-C-O 120.824 0.345 . . . . 0.0 110.198 179.167 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.445 ' HD3' ' O ' ' A' ' 6' ' ' GLU . 13.9 mptt -69.25 -36.52 77.25 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.027 173.244 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 49.7 m0 -60.83 -36.82 80.08 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 172.05 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -70.58 2.26 16.99 Favored Glycine 0 CA--C 1.521 0.418 0 CA-C-N 114.91 -1.041 . . . . 0.0 113.711 -177.063 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.408 ' HG3' ' O ' ' A' ' 10' ' ' LYS . 2.8 pp20? -127.74 -3.09 5.96 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 117.394 0.597 . . . . 0.0 111.499 177.326 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 74.0 m -153.34 105.78 2.89 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 120.667 0.27 . . . . 0.0 111.005 177.781 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.414 ' O ' ' HB3' ' A' ' 18' ' ' LEU . 30.9 t80 -58.33 -36.77 73.9 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 121.031 0.443 . . . . 0.0 109.932 178.292 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -57.43 -45.41 84.7 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.03 176.48 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.404 ' HB2' ' HE3' ' A' ' 17' ' ' LYS . 37.5 ttmt -65.07 -36.47 84.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.975 -178.513 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.414 ' HB3' ' O ' ' A' ' 15' ' ' PHE . 36.0 tp -59.73 -51.49 69.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.671 175.305 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 21.4 tp -80.49 -24.05 39.72 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.786 -171.704 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 70.7 m -69.57 -27.02 64.77 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.072 0.463 . . . . 0.0 110.629 178.11 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -80.15 129.73 34.71 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.568 174.067 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 10.6 tpt180 -59.47 -32.99 70.76 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 174.4 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -57.57 -50.82 71.85 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.536 176.655 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -70.78 -41.3 63.62 Favored Glycine 0 N--CA 1.449 -0.46 0 CA-C-N 115.014 -0.993 . . . . 0.0 112.217 -177.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 9.6 tt -60.21 -47.34 86.38 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 122.783 0.433 . . . . 0.0 110.226 179.572 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.593 ' O ' ' HG2' ' A' ' 30' ' ' ARG . 9.3 tp10 -65.09 -49.35 70.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.827 -179.339 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -59.74 -42.11 92.42 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.071 -179.646 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 76.9 t80 -68.64 -48.38 64.19 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.059 -176.449 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.424 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 14.6 t -60.53 -36.01 77.36 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 120.695 0.283 . . . . 0.0 110.544 -177.403 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.593 ' HG2' ' O ' ' A' ' 26' ' ' GLU . 21.6 mmt180 -62.53 -52.8 62.01 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.025 0.441 . . . . 0.0 110.326 178.735 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.558 ' O ' HG23 ' A' ' 34' ' ' THR . 84.5 t80 -65.31 -31.03 71.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.609 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 17.7 tp -74.03 -26.77 60.61 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.435 -179.199 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.424 ' HG3' ' O ' ' A' ' 29' ' ' THR . 67.3 mttm -76.95 -34.77 57.59 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.26 178.839 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.558 HG23 ' O ' ' A' ' 31' ' ' PHE . 7.2 t -71.17 -8.52 54.05 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.785 0.326 . . . . 0.0 111.095 -177.013 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -119.24 17.34 13.13 Favored 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 173.142 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 33.4 p90 43.41 29.94 0.28 Allowed 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.171 0.988 . . . . 0.0 112.822 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 31.5 m -95.63 8.88 42.13 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.184 176.375 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -56.8 -21.06 25.93 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.066 -179.205 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.427 ' HG3' ' N ' ' A' ' 40' ' ' ASN . 8.9 pt-20 -49.62 -37.24 27.21 Favored 'General case' 0 C--O 1.225 -0.216 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.271 177.628 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . 0.427 ' N ' ' HG3' ' A' ' 39' ' ' GLU . 46.9 m-80 -60.77 -61.31 2.68 Favored 'General case' 0 C--O 1.24 0.605 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.803 -174.215 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 13.0 tt -64.47 -34.02 66.75 Favored 'Isoleucine or valine' 0 C--O 1.235 0.309 0 CA-C-O 121.053 0.454 . . . . 0.0 110.019 -177.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.465 ' O ' HG21 ' A' ' 45' ' ' ILE . 6.3 tp10 -72.74 -25.94 61.39 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.166 -179.309 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.419 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 71.9 t80 -64.63 -65.1 0.72 Allowed 'General case' 0 C--O 1.236 0.384 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.713 179.136 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 32.6 p-90 -78.08 -9.72 59.28 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 119.747 -0.781 . . . . 0.0 112.385 -173.364 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.602 ' O ' ' HG3' ' A' ' 48' ' ' GLU . 9.5 tt -75.17 -31.54 24.76 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.201 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 169.502 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.28 -29.31 69.51 Favored 'General case' 0 C--O 1.232 0.137 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 172.472 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.558 ' SG ' ' HB2' ' A' ' 101' ' ' PHE . 52.7 t -66.22 -32.73 74.33 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.349 176.309 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.605 ' O ' ' HG2' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -82.91 -28.79 29.69 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 177.379 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.432 ' O ' ' HB2' ' A' ' 52' ' ' LYS . 15.6 t70 -58.41 -27.61 64.45 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.742 0.782 . . . . 0.0 109.094 167.386 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.494 ' HB3' ' O ' ' A' ' 47' ' ' CYS . 42.4 t80 -79.3 -30.11 42.75 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 114.87 -1.059 . . . . 0.0 111.211 175.416 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.605 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 10.0 ptmt -60.74 -22.79 64.38 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 174.792 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.432 ' HB2' ' O ' ' A' ' 49' ' ' ASP . 14.0 mptt -72.47 56.79 0.37 Allowed 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.311 168.661 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 48.1 t -141.7 94.04 2.63 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.939 0.4 . . . . 0.0 109.939 175.159 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.63 -6.88 59.56 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.836 -179.757 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -106.8 123.19 7.24 Favored Glycine 0 CA--C 1.519 0.302 0 CA-C-O 119.735 -0.48 . . . . 0.0 111.916 -179.597 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_exo -56.39 -26.56 63.28 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.721 2.28 . . . . 0.0 112.507 179.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 30.5 mm-40 -71.49 -45.46 62.45 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 174.458 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 75.3 mm-40 -59.23 -31.75 69.35 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.06 179.342 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 37.2 mm -50.9 -54.43 10.26 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.115 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.614 176.099 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 37.5 m-70 -65.86 -36.5 83.62 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.84 -177.67 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 83.4 mt -68.73 -51.77 37.8 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.458 -176.459 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 52.2 mtpt -71.39 -31.45 67.3 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.413 -177.65 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.72 -42.01 87.01 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 120.968 0.413 . . . . 0.0 110.06 174.415 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 22.5 tptp -59.52 -35.2 73.72 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.097 176.431 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -65.03 -57.2 9.27 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.584 176.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 65.3 mt -58.64 -33.33 48.43 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 CA-C-O 121.204 0.526 . . . . 0.0 110.337 179.209 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.509 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 50.5 t80 -55.86 -61.9 2.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.449 177.426 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -71.25 -31.27 67.33 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.728 -174.732 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -82.79 -25.4 32.79 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.755 -174.491 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 85.7 m-85 -133.56 -53.74 0.88 Allowed 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -174.608 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.509 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 50.0 mm -70.72 -29.54 38.39 Favored 'Isoleucine or valine' 0 C--O 1.238 0.492 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 -170.471 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -64.63 143.29 58.03 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.018 -173.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.8 m -63.19 -39.56 95.0 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.06 178.263 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -101.24 92.51 5.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.538 0.685 . . . . 0.0 109.708 172.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.497 ' HB3' ' HD2' ' A' ' 76' ' ' PRO . . . -123.27 161.33 45.82 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.2 -176.312 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.497 ' HD2' ' HB3' ' A' ' 75' ' ' ALA . 4.1 Cg_endo -45.63 -37.37 15.49 Favored 'Trans proline' 0 C--N 1.356 0.958 0 C-N-CA 123.451 2.767 . . . . 0.0 113.02 -178.143 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 8.7 ttpp -139.93 -3.43 1.43 Allowed 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.615 -0.266 . . . . 0.0 111.081 176.6 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.49 ' HA ' ' HB1' ' A' ' 75' ' ' ALA . 54.8 mt-10 60.94 157.27 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 121.457 0.646 . . . . 0.0 111.92 -176.138 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 68.0 t -119.94 144.84 27.34 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.494 175.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 39.1 m-80 -81.59 19.93 0.97 Allowed 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 111.981 0.363 . . . . 0.0 111.981 -176.109 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 28.0 tp -65.77 140.39 58.42 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 175.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.406 ' OD2' ' HB3' ' A' ' 84' ' ' HIS . 8.4 p-10 -64.29 156.66 28.26 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.139 0.495 . . . . 0.0 112.098 -171.749 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.403 ' HA ' ' HG2' ' A' ' 86' ' ' LYS . 96.8 m-85 -60.07 -40.43 89.47 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.059 -178.514 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . 0.457 ' O ' HG23 ' A' ' 88' ' ' VAL . 24.0 t60 -53.61 -56.3 18.34 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.314 -179.175 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.429 ' OG1' ' HG3' ' A' ' 107' ' ' ARG . 29.2 m -72.06 -42.41 66.27 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.856 -174.588 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.663 ' HB2' ' HZ1' ' A' ' 86' ' ' LYS . 0.1 OUTLIER -65.76 -31.85 73.07 Favored 'General case' 0 N--CA 1.463 0.181 0 C-N-CA 120.753 -0.379 . . . . 0.0 110.203 -178.985 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -62.54 -47.93 81.73 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.328 0.585 . . . . 0.0 109.947 177.242 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.457 HG23 ' O ' ' A' ' 84' ' ' HIS . 98.1 t -53.7 -46.3 61.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.554 178.687 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 56.9 mt -72.42 -40.9 64.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.535 -176.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 22.0 p -62.87 -21.67 66.14 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.788 0.327 . . . . 0.0 111.25 -178.372 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 35.4 m-80 -96.46 -38.6 9.95 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.094 176.146 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 16.8 t -83.35 0.06 47.6 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.596 -0.274 . . . . 0.0 111.468 -175.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 8.0 tp -57.38 -26.59 26.59 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 CA-C-O 120.866 0.365 . . . . 0.0 111.628 -178.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.405 HG21 ' HG2' ' A' ' 95' ' ' GLN . 9.9 t -66.45 -28.2 68.42 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 120.978 0.418 . . . . 0.0 110.984 179.313 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.405 ' HG2' HG21 ' A' ' 94' ' ' THR . 22.7 pt20 -139.21 71.45 40.01 Favored Pre-proline 0 CA--C 1.534 0.355 0 CA-C-O 121.129 0.49 . . . . 0.0 110.548 -178.736 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -87.6 131.78 2.91 Favored 'Trans proline' 0 N--CA 1.459 -0.523 0 C-N-CA 122.735 2.29 . . . . 0.0 112.477 -178.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' THR . . . . . 0.462 ' N ' ' HB2' ' A' ' 100' ' ' SER . 37.9 p -83.52 171.77 13.04 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.411 174.59 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 36.9 tp -61.02 -26.03 67.32 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 121.266 0.555 . . . . 0.0 110.526 -178.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' HIS . . . . . 0.557 ' HB3' ' HB2' ' A' ' 102' ' ' ASP . 23.3 m-70 -119.74 34.37 5.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.522 177.171 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' SER . . . . . 0.462 ' HB2' ' N ' ' A' ' 97' ' ' THR . 22.2 t -61.74 -31.81 72.01 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.32 177.337 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.558 ' HB2' ' SG ' ' A' ' 47' ' ' CYS . 88.0 m-85 -91.9 6.36 46.5 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.966 -178.77 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . 0.557 ' HB2' ' HB3' ' A' ' 99' ' ' HIS . 12.8 t70 -64.11 -41.65 97.17 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.117 0.484 . . . . 0.0 110.347 -177.178 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.433 ' O ' ' HG2' ' A' ' 107' ' ' ARG . . . -59.32 -43.3 92.68 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.179 176.254 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.0 -37.41 85.84 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.413 177.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 21.5 tm0? -57.86 -45.38 86.4 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.169 176.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' SER . . . . . 0.66 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 47.7 t -60.15 -58.44 8.53 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.527 -0.761 . . . . 0.0 110.165 176.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . 0.435 ' O ' ' HG ' ' A' ' 111' ' ' LEU . 23.2 mmm180 -49.22 -55.42 12.62 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 120.945 0.402 . . . . 0.0 111.336 -177.864 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 74.6 t -57.44 -40.03 72.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.026 179.444 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . 0.504 ' HA ' ' HE3' ' A' ' 112' ' ' MET . 55.6 t80 -64.26 -37.35 87.16 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.772 178.714 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . 0.66 ' HG3' ' O ' ' A' ' 106' ' ' SER . 42.7 mt-30 -67.56 -42.1 83.15 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 178.24 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.435 ' HG ' ' O ' ' A' ' 107' ' ' ARG . 93.4 mt -59.71 -45.02 93.42 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.819 -1.082 . . . . 0.0 110.679 -179.171 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' MET . . . . . 0.504 ' HE3' ' HA ' ' A' ' 109' ' ' TYR . 54.5 mtm -62.08 -41.34 98.07 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 176.811 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . 0.619 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 4.5 tm-20 -61.92 -71.03 0.16 Allowed 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.913 -176.169 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -57.69 -18.13 19.01 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -171.487 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . 0.45 ' O ' ' HD3' ' A' ' 119' ' ' ARG . 7.8 m-20 -118.26 -75.99 0.58 Allowed 'General case' 0 N--CA 1.463 0.201 0 N-CA-C 111.576 0.213 . . . . 0.0 111.576 179.075 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 17.6 m -58.56 -28.37 65.46 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -171.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . 0.619 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 68.4 t80 -78.11 -45.32 23.71 Favored 'General case' 0 C--N 1.333 -0.123 0 N-CA-C 110.694 -0.113 . . . . 0.0 110.694 -176.825 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' THR . . . . . 0.521 HG22 ' HD2' ' A' ' 119' ' ' ARG . 11.5 t -66.62 -40.22 88.68 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-O 120.918 0.389 . . . . 0.0 110.151 178.294 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . 0.521 ' HD2' HG22 ' A' ' 118' ' ' THR . 3.1 mpt_? -61.53 -38.66 88.22 Favored 'General case' 0 N--CA 1.461 0.104 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 173.754 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . 0.488 ' HA ' ' HB3' ' A' ' 123' ' ' SER . 76.8 t80 -64.7 -36.16 83.39 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.322 177.38 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.47 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 89.9 mt -59.76 -28.99 67.87 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.646 0.26 . . . . 0.0 110.576 178.035 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . 0.451 ' HD3' ' HA ' ' A' ' 122' ' ' LYS . 31.1 mmtp -115.1 16.9 16.97 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 176.121 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' SER . . . . . 0.488 ' HB3' ' HA ' ' A' ' 120' ' ' PHE . 83.6 p -70.42 141.48 52.12 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 173.408 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -55.88 -38.14 69.75 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.243 -178.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.467 ' O ' ' HG ' ' A' ' 129' ' ' LEU . 7.7 tp -65.09 -42.86 95.54 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.147 -179.318 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 73.6 t80 -69.62 -36.97 76.64 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.743 0.306 . . . . 0.0 110.684 -179.609 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 94.4 mt -66.39 -29.88 70.14 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 120.934 0.397 . . . . 0.0 110.019 177.3 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -65.53 -34.05 77.35 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.048 173.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 125' ' ' ILE . 55.2 mt -76.3 -29.95 57.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.592 177.325 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' MET . . . . . . . . . . . . . 4.7 mmt . . . . . 0 N--CA 1.47 0.533 0 CA-C-N 116.094 -0.503 . . . . 0.0 112.128 -179.451 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . 0.444 HG11 ' CH2' ' A' ' 11' ' ' TRP . 8.6 p . . . . . 0 C--O 1.233 0.219 0 CA-C-O 120.968 0.413 . . . . 0.0 111.494 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 36.9 m -66.06 132.06 94.56 Favored Pre-proline 0 CA--C 1.534 0.363 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.889 172.602 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_exo -49.14 -33.98 29.06 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 123.159 2.573 . . . . 0.0 113.433 -176.012 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.494 ' O ' ' HG2' ' A' ' 10' ' ' LYS . 42.1 mt-10 -61.76 -45.61 93.17 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-O 120.809 0.337 . . . . 0.0 110.803 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.403 ' O ' ' HB2' ' A' ' 10' ' ' LYS . 17.4 tp10 -70.22 -33.38 71.6 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.155 0.502 . . . . 0.0 109.7 177.814 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.21 -45.5 92.98 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.804 179.124 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 30.7 m -75.02 -19.06 16.28 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-O 120.758 0.313 . . . . 0.0 110.837 179.486 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.494 ' HG2' ' O ' ' A' ' 6' ' ' GLU . 72.0 mmtt -67.06 -29.1 68.79 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.513 173.274 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . 0.444 ' CH2' HG11 ' A' ' 3' ' ' VAL . 54.2 m0 -62.08 -24.11 66.91 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.074 -179.28 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -65.59 -12.07 55.26 Favored Glycine 0 CA--C 1.521 0.424 0 C-N-CA 121.173 -0.537 . . . . 0.0 112.593 177.325 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -74.71 -49.67 20.31 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 120.718 0.294 . . . . 0.0 110.611 177.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 30.5 m -154.19 128.76 9.26 Favored 'General case' 0 C--O 1.24 0.575 0 CA-C-O 121.024 0.44 . . . . 0.0 111.639 -175.127 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.443 ' CD1' HD22 ' A' ' 18' ' ' LEU . 84.8 t80 -55.55 -26.84 45.55 Favored 'General case' 0 N--CA 1.461 0.111 0 CA-C-N 115.641 -0.708 . . . . 0.0 109.931 175.141 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -51.89 -55.39 20.43 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.377 -0.828 . . . . 0.0 111.168 177.243 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.471 ' HD2' ' O ' ' A' ' 10' ' ' LYS . 17.3 ptpt -71.94 -30.42 65.3 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 120.927 -0.309 . . . . 0.0 110.363 -176.616 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.443 HD22 ' CD1' ' A' ' 15' ' ' PHE . 51.6 tp -56.32 -51.93 66.43 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.068 -0.514 . . . . 0.0 109.98 175.052 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 51.4 tp -71.19 -35.26 71.51 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.86 -178.138 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.0 m -74.3 -22.26 59.36 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.878 -177.103 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.9 t-80 -90.61 117.66 29.45 Favored 'General case' 0 N--CA 1.462 0.134 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 -179.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.461 ' HD3' ' H ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -36.68 -53.46 0.9 Allowed 'General case' 0 N--CA 1.475 0.817 0 O-C-N 123.847 0.717 . . . . 0.0 111.852 -176.682 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -56.93 -45.36 82.8 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.77 -177.454 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -65.95 -44.64 91.31 Favored Glycine 0 C--N 1.333 0.372 0 CA-C-N 115.727 -0.669 . . . . 0.0 111.791 -179.198 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 8.0 tt -57.9 -44.84 87.03 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.888 0.375 . . . . 0.0 110.299 177.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -64.33 -46.43 83.54 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.555 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -63.76 -35.41 80.49 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 120.999 0.428 . . . . 0.0 110.504 179.597 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -71.0 -49.51 44.45 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.419 -0.809 . . . . 0.0 110.956 -176.393 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 9.1 t -62.86 -36.12 82.24 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 120.656 0.265 . . . . 0.0 110.704 -178.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 74.6 mtm180 -64.92 -38.94 92.63 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 120.731 0.3 . . . . 0.0 111.104 179.661 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.557 ' O ' HG21 ' A' ' 34' ' ' THR . 87.0 t80 -76.55 -50.69 13.3 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.055 0.455 . . . . 0.0 110.553 178.789 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 36.8 tp -58.36 -24.95 61.37 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.011 -178.495 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 24.0 ttmm -63.75 -33.22 75.16 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.599 -178.665 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.557 HG21 ' O ' ' A' ' 31' ' ' PHE . 6.2 t -68.82 -20.51 64.31 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 121.183 -0.207 . . . . 0.0 111.457 -174.966 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -105.03 -1.5 25.61 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.806 0.336 . . . . 0.0 110.463 177.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 61.62 18.99 10.05 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 115.734 -0.666 . . . . 0.0 112.306 175.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.3 m -84.05 2.92 36.9 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 121.077 0.465 . . . . 0.0 109.955 176.157 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -51.65 -21.99 3.07 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.252 -0.886 . . . . 0.0 112.709 -177.46 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.472 ' CD ' ' HZ2' ' A' ' 77' ' ' LYS . 26.1 mt-10 -58.61 -17.27 20.69 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -176.663 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . 0.446 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 20.7 p30 -67.78 -39.44 84.08 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 121.269 0.557 . . . . 0.0 110.044 175.329 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.449 ' HA ' ' CZ2' ' A' ' 44' ' ' TRP . 58.6 mt -65.53 -47.34 86.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.68 175.406 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.426 ' HA ' HG21 ' A' ' 45' ' ' ILE . 2.8 mp0 -64.51 -24.0 67.46 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.931 176.239 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.446 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 60.3 t80 -61.58 -62.91 1.48 Allowed 'General case' 0 C--O 1.237 0.445 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.464 179.728 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.449 ' CZ2' ' HA ' ' A' ' 41' ' ' ILE . 3.6 p-90 -82.78 -7.81 59.63 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 120.292 -0.563 . . . . 0.0 112.422 -177.678 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.426 HG21 ' HA ' ' A' ' 42' ' ' GLU . 5.5 tt -76.9 -30.37 18.2 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 171.377 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.25 -35.5 71.43 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.735 173.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.404 ' O ' ' HB3' ' A' ' 50' ' ' PHE . 71.3 m -63.88 -33.74 76.38 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.12 174.524 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.599 ' O ' ' HG3' ' A' ' 52' ' ' LYS . 3.5 tm-20 -63.59 -51.24 66.19 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 108.434 -0.951 . . . . 0.0 108.434 173.109 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.542 ' HA ' ' CD ' ' A' ' 52' ' ' LYS . 27.5 t70 -50.36 -31.98 16.12 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.601 176.447 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.404 ' HB3' ' O ' ' A' ' 47' ' ' CYS . 78.9 t80 -70.51 -43.82 68.87 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.548 -178.578 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.566 ' HE3' ' HG2' ' A' ' 48' ' ' GLU . 18.6 pttp -69.13 -16.58 63.69 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 120.89 0.376 . . . . 0.0 110.823 -177.502 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.599 ' HG3' ' O ' ' A' ' 48' ' ' GLU . 15.8 mtpp -75.78 -14.02 60.3 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.256 178.739 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 79.4 p -58.22 -47.83 82.27 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.254 -175.669 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 46.91 18.57 0.07 Allowed 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.285 1.034 . . . . 0.0 112.769 -179.413 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . 0.458 ' O ' HG12 ' A' ' 59' ' ' ILE . . . -129.89 123.34 4.02 Favored Glycine 0 C--N 1.331 0.251 0 N-CA-C 111.313 -0.715 . . . . 0.0 111.313 -179.121 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -48.9 -52.16 9.18 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 123.378 2.719 . . . . 0.0 112.851 -173.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 27.2 pt20 -63.17 -39.46 94.71 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 120.717 0.294 . . . . 0.0 111.085 -179.214 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -68.47 -26.51 65.52 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.395 -178.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.458 HG12 ' O ' ' A' ' 55' ' ' GLY . 38.4 mm -55.91 -49.81 72.78 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.213 0 CA-C-O 121.07 0.462 . . . . 0.0 110.169 175.36 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 63.4 m-70 -64.92 -35.29 80.69 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.375 -177.409 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 93.8 mt -73.13 -54.32 8.79 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.518 -176.364 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 32.4 mmtp -63.74 -35.67 81.36 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.539 0.209 . . . . 0.0 110.785 -179.459 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.47 -48.82 80.1 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.189 176.499 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 17.9 tppt? -57.26 -40.42 77.66 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.611 177.266 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.53 -64.05 1.08 Allowed 'General case' 0 C--O 1.234 0.238 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.795 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 64.7 mt -56.39 -36.82 48.32 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 CA-C-O 121.14 0.495 . . . . 0.0 110.542 -179.463 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.459 ' CE1' HG21 ' A' ' 90' ' ' THR . 8.3 t80 -54.55 -73.94 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.348 -179.791 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -75.68 -3.55 35.28 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 -172.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.5 tppt? -95.18 -34.89 12.08 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 120.981 -0.288 . . . . 0.0 110.677 177.654 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 72.8 m-85 -130.93 -52.74 1.05 Allowed 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -173.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.428 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 46.4 mm -61.0 -44.19 97.69 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 CA-C-O 121.146 0.498 . . . . 0.0 111.388 -171.883 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -69.12 135.35 50.59 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.606 -175.032 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 22.1 m -70.11 -31.88 69.64 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.541 0.686 . . . . 0.0 109.353 176.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -83.74 13.26 4.9 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.151 -0.931 . . . . 0.0 110.816 176.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.556 ' HB3' ' HD2' ' A' ' 76' ' ' PRO . . . -63.76 160.21 47.13 Favored Pre-proline 0 CA--C 1.532 0.286 0 CA-C-N 116.394 -0.367 . . . . 0.0 110.133 176.118 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . 0.556 ' HD2' ' HB3' ' A' ' 75' ' ' ALA . 8.7 Cg_endo -50.27 -30.07 25.09 Favored 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 123.005 2.47 . . . . 0.0 113.164 -174.935 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.502 ' HD2' ' O ' ' A' ' 78' ' ' GLU . 0.1 OUTLIER -146.1 8.47 1.08 Allowed 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 120.639 0.257 . . . . 0.0 111.155 177.781 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 0.538 ' HA ' ' HB1' ' A' ' 75' ' ' ALA . 9.8 pt-20 45.01 -172.98 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 124.715 1.206 . . . . 0.0 114.022 -179.871 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 54.3 t -153.99 139.54 11.02 Favored 'Isoleucine or valine' 0 C--O 1.237 0.408 0 CA-C-N 114.812 -1.086 . . . . 0.0 108.173 178.203 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 -70.39 88.04 0.64 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.637 0.732 . . . . 0.0 111.082 -179.074 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 14.0 tp -133.91 145.0 49.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 114.751 -1.113 . . . . 0.0 109.175 178.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -54.12 142.15 26.47 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 121.299 0.571 . . . . 0.0 112.256 -176.168 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 40.8 p90 -66.5 -43.51 85.13 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.109 -0.95 . . . . 0.0 111.789 -176.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . 0.408 ' O ' ' HB3' ' A' ' 87' ' ' GLU . 85.2 t60 -70.37 -30.41 67.33 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.109 0.481 . . . . 0.0 110.461 -175.854 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 47.3 m -64.82 -52.15 58.28 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.285 177.666 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.449 ' O ' HG23 ' A' ' 90' ' ' THR . 18.0 ptpt -70.64 -24.04 62.64 Favored 'General case' 0 C--O 1.226 -0.164 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.623 -178.697 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.408 ' HB3' ' O ' ' A' ' 84' ' ' HIS . 12.0 tp10 -54.17 -58.73 6.24 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-O 121.448 0.642 . . . . 0.0 110.014 173.406 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 61.4 t -56.09 -42.26 71.81 Favored 'Isoleucine or valine' 0 C--O 1.237 0.44 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.303 178.458 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 70.1 mt -60.71 -47.36 93.4 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.248 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.207 -179.231 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.459 HG21 ' CE1' ' A' ' 67' ' ' TYR . 60.3 p -59.57 -30.56 68.73 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 121.037 0.446 . . . . 0.0 110.8 -177.599 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 -87.01 -17.29 33.34 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 115.817 -0.629 . . . . 0.0 112.26 -175.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 43.3 p -121.66 3.6 10.11 Favored 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 -179.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.6 tp -61.53 -23.51 30.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 CA-C-O 120.776 0.322 . . . . 0.0 111.631 -175.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.41 HG22 ' HG3' ' A' ' 95' ' ' GLN . 9.7 t -67.28 -32.97 74.32 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.131 -178.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.41 ' HG3' HG22 ' A' ' 94' ' ' THR . 96.4 mt-30 -136.33 75.58 52.04 Favored Pre-proline 0 N--CA 1.464 0.274 0 N-CA-C 110.321 -0.251 . . . . 0.0 110.321 -178.603 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -92.76 176.45 1.62 Allowed 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 122.82 2.346 . . . . 0.0 112.713 179.13 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 75.4 p -117.31 178.28 4.43 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.426 175.519 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -57.19 -24.94 57.89 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 112.154 0.427 . . . . 0.0 112.154 -173.36 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 93.8 m-70 -138.93 31.17 2.22 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 112.365 0.506 . . . . 0.0 112.365 -177.024 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 66.0 m -62.08 -21.57 65.06 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 121.078 0.465 . . . . 0.0 110.941 175.221 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -81.82 8.2 10.83 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.374 -179.676 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -60.79 -37.99 83.8 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 120.629 0.252 . . . . 0.0 110.479 -177.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.45 -43.23 99.22 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.661 177.499 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.34 -46.54 79.82 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.507 179.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.442 ' HG2' ' HB3' ' A' ' 44' ' ' TRP . 46.4 mt-30 -60.29 -41.81 94.16 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.007 177.719 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' SER . . . . . 0.671 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 45.7 t -55.82 -58.49 7.64 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.851 178.238 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 2.5 mmp_? -46.98 -59.05 3.37 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.584 -178.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.527 ' O ' ' HG3' ' A' ' 112' ' ' MET . 11.4 p -64.7 -33.35 62.7 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.552 -175.862 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . 0.504 ' HA ' ' HE1' ' A' ' 112' ' ' MET . 15.8 t80 -66.5 -43.54 85.02 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.2 -179.521 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . 0.671 ' HG3' ' O ' ' A' ' 106' ' ' SER . 31.1 mt-30 -62.7 -40.3 96.72 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 121.666 0.746 . . . . 0.0 109.014 177.599 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 89.7 mt -60.63 -41.0 94.01 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.531 -1.213 . . . . 0.0 110.415 176.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' MET . . . . . 0.527 ' HG3' ' O ' ' A' ' 108' ' ' VAL . 46.2 mtm -60.87 -39.66 90.01 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 177.338 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . 0.58 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 43.9 tt0 -61.42 -65.97 0.61 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.918 0.39 . . . . 0.0 110.208 179.104 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . 0.406 ' HG2' ' O ' ' A' ' 110' ' ' GLN . 10.7 pt20 -75.07 16.0 0.36 Allowed 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -172.843 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -141.99 -65.44 0.42 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.724 0.297 . . . . 0.0 110.686 173.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 4.2 m -68.21 -38.35 81.82 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.391 -176.351 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . 0.58 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 36.1 t80 -71.51 -40.83 69.88 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 110.285 -0.265 . . . . 0.0 110.285 -175.027 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 29.4 p -63.39 -43.56 97.23 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 120.921 0.391 . . . . 0.0 110.239 177.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 69.0 mtp85 -60.0 -40.49 89.4 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.003 174.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 58.3 t80 -66.58 -34.15 77.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.204 179.243 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.489 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 95.6 mt -65.27 -26.3 68.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.949 0.404 . . . . 0.0 110.249 175.562 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . 0.622 ' HE2' ' HA ' ' A' ' 122' ' ' LYS . 11.4 mmpt? -88.58 -16.44 32.52 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.335 179.263 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 59.1 p -61.66 139.9 58.24 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 120.99 0.424 . . . . 0.0 111.198 -177.161 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 16.6 p-10 -62.37 -31.31 71.95 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.814 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -64.43 -45.26 96.35 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.393 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' TYR . . . . . 0.443 ' O ' ' HG2' ' A' ' 130' ' ' MET . 69.5 t80 -69.12 -43.18 74.95 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 120.786 0.326 . . . . 0.0 110.333 -179.488 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 99.4 mt -60.42 -35.99 77.11 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.496 178.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -63.72 -38.99 93.2 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.347 177.215 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 91.8 mt -70.54 -27.52 64.22 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.986 179.263 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' MET . . . . . 0.459 ' HA ' ' HE1' ' A' ' 130' ' ' MET . 30.1 mmt . . . . . 0 N--CA 1.463 0.204 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.223 179.113 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . 0.445 HG11 HD22 ' A' ' 129' ' ' LEU . 7.0 p . . . . . 0 CA--C 1.533 0.305 0 CA-C-O 121.491 0.662 . . . . 0.0 112.749 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 32.2 t -133.66 150.28 74.38 Favored Pre-proline 0 CA--C 1.534 0.351 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 173.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_exo -43.38 -40.74 10.05 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.905 2.404 . . . . 0.0 113.018 179.87 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.512 ' O ' ' HG2' ' A' ' 10' ' ' LYS . 37.6 tt0 -66.81 -39.55 87.76 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 121.146 0.498 . . . . 0.0 110.453 178.744 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -63.04 -35.84 81.57 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.232 0.539 . . . . 0.0 109.557 177.267 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.88 -45.2 93.66 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.553 -0.748 . . . . 0.0 111.346 -178.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.509 HG22 ' O ' ' A' ' 6' ' ' GLU . 24.6 m -67.56 -26.41 35.47 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.293 0 CA-C-O 120.765 0.317 . . . . 0.0 110.589 179.877 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.512 ' HG2' ' O ' ' A' ' 6' ' ' GLU . 74.3 mmtt -65.95 -29.5 69.92 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.263 0.554 . . . . 0.0 110.145 174.692 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 36.4 m0 -79.07 -30.07 43.75 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 174.321 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -69.64 -11.46 65.6 Favored Glycine 0 C--N 1.332 0.354 0 CA-C-N 115.286 -0.87 . . . . 0.0 112.65 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -106.83 -36.3 6.7 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 120.705 0.288 . . . . 0.0 110.778 175.547 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 46.4 t -123.85 105.5 9.69 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 120.905 0.383 . . . . 0.0 111.081 -176.184 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.403 ' O ' HD11 ' A' ' 19' ' ' LEU . 30.1 t80 -61.67 -33.64 74.34 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.995 177.391 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -61.15 -40.9 95.57 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.389 175.365 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.735 ' HB2' ' HZ3' ' A' ' 17' ' ' LYS . 4.1 ttmp? -69.75 -33.33 72.3 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.061 -178.457 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 67.6 tp -56.83 -48.52 77.84 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.029 173.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.403 HD11 ' O ' ' A' ' 15' ' ' PHE . 4.9 mp -76.0 -26.47 56.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.011 -179.619 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.0 t -72.92 -35.21 66.99 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.479 -178.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 -86.87 125.01 33.71 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.379 -0.601 . . . . 0.0 109.379 -178.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.427 ' O ' ' HB2' ' A' ' 26' ' ' GLU . 17.5 ttp180 -46.27 -47.27 18.2 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 122.87 0.468 . . . . 0.0 111.361 -178.283 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -58.59 -41.45 85.82 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.125 -179.172 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -67.09 -52.19 34.01 Favored Glycine 0 N--CA 1.449 -0.444 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.95 -177.434 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.1 tt -56.49 -40.94 75.81 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.091 0.472 . . . . 0.0 110.173 176.147 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.427 ' HB2' ' O ' ' A' ' 22' ' ' ARG . 1.1 tm-20 -59.04 -55.69 31.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.667 179.804 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.512 ' HA ' ' HD3' ' A' ' 30' ' ' ARG . . . -65.85 -39.29 90.61 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.8 -177.196 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -67.33 -40.94 85.96 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.919 -175.445 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 29.1 p -62.81 -45.01 94.61 Favored 'General case' 0 CA--C 1.529 0.147 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 178.238 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.512 ' HD3' ' HA ' ' A' ' 27' ' ' ALA . 53.0 mtp180 -54.23 -44.36 71.64 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.508 176.286 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.54 ' O ' HG22 ' A' ' 34' ' ' THR . 77.6 t80 -58.94 -48.2 82.34 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.756 178.542 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 14.2 tp -76.05 -10.9 59.79 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.012 -175.056 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -92.56 -9.87 39.64 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.552 177.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.54 HG22 ' O ' ' A' ' 31' ' ' PHE . 2.4 t -76.09 -15.57 60.07 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 121.517 0.675 . . . . 0.0 110.019 178.327 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.427 ' O ' ' N ' ' A' ' 37' ' ' SER . 7.9 pt-20 -145.9 90.58 1.99 Allowed 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 108.358 -0.978 . . . . 0.0 108.358 176.013 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 18.2 p90 -29.65 82.63 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 114.279 1.215 . . . . 0.0 114.279 -171.309 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' SER . . . . . 0.427 ' N ' ' O ' ' A' ' 35' ' ' GLU . 16.0 m -134.54 9.21 3.66 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 168.938 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -58.78 -32.13 69.02 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 114.1 -1.409 . . . . 0.0 111.603 -175.522 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.473 ' O ' ' HB2' ' A' ' 43' ' ' PHE . 5.1 mp0 -58.76 -20.21 47.52 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.645 -175.34 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . 0.612 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 44.7 m-80 -75.81 -56.64 4.48 Favored 'General case' 0 C--O 1.241 0.646 0 CA-C-O 121.069 0.462 . . . . 0.0 111.092 -179.02 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.476 ' O ' HG13 ' A' ' 45' ' ' ILE . 10.0 tt -62.14 -43.84 98.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 179.511 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.574 ' HA ' ' HB ' ' A' ' 45' ' ' ILE . 52.1 mt-10 -72.75 -16.53 61.64 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.808 -179.009 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.612 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 66.5 t80 -61.27 -58.32 8.76 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 172.249 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.415 ' O ' ' HB3' ' A' ' 47' ' ' CYS . 37.1 p-90 -78.43 -15.21 58.9 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 119.404 -0.919 . . . . 0.0 111.493 -179.504 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.574 ' HB ' ' HA ' ' A' ' 42' ' ' GLU . 60.4 mt -69.03 -34.3 63.25 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.292 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 168.598 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.67 -31.84 73.13 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.965 -0.562 . . . . 0.0 109.784 173.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.42 ' O ' ' HB3' ' A' ' 50' ' ' PHE . 53.6 t -63.83 -33.6 76.05 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.587 173.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.442 ' HB3' ' O ' ' A' ' 45' ' ' ILE . 15.0 tp10 -66.16 -49.11 68.52 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 174.671 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.427 ' HA ' ' HG2' ' A' ' 52' ' ' LYS . 0.3 OUTLIER -66.66 -15.79 63.74 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.7 176.188 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.497 ' CZ ' HG22 ' A' ' 59' ' ' ILE . 92.7 t80 -78.44 -43.1 28.11 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.879 174.941 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.406 ' HD3' ' CE1' ' A' ' 99' ' ' HIS . 31.8 ttpt -61.13 -38.83 87.78 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.182 -179.359 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.427 ' HG2' ' HA ' ' A' ' 49' ' ' ASP . 21.9 ptmt -76.05 14.32 0.72 Allowed 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.665 -177.329 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.444 ' HB2' HD13 ' A' ' 59' ' ' ILE . 6.5 m -94.45 88.62 5.55 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 175.116 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.3 pptp? -74.27 -9.62 58.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.297 -177.186 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -91.19 118.52 5.43 Favored Glycine 0 N--CA 1.448 -0.505 0 N-CA-C 111.559 -0.617 . . . . 0.0 111.559 175.562 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . 0.454 ' O ' ' HB ' ' A' ' 59' ' ' ILE . 19.3 Cg_endo -56.65 -30.33 83.24 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.847 2.365 . . . . 0.0 112.019 -176.991 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . 0.404 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 25.1 mt-30 -71.88 -45.32 61.72 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.916 -0.583 . . . . 0.0 109.858 177.805 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 50.9 tp60 -59.0 -33.13 70.36 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.848 179.256 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.497 HG22 ' CZ ' ' A' ' 50' ' ' PHE . 23.1 mm -55.24 -56.69 10.12 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.732 174.369 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 18.7 m-70 -59.73 -39.78 85.82 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.211 -176.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' A' ' 57' ' ' GLN . 94.6 mt -58.02 -59.61 5.01 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.387 -177.318 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 58.1 mtmt -72.4 -25.39 61.47 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.401 -176.475 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.61 -49.2 74.24 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 120.954 0.407 . . . . 0.0 110.579 176.711 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -63.83 -37.35 87.05 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.546 -179.207 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.9 -52.97 63.46 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.922 179.115 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 68.7 mt -63.53 -35.35 72.24 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.295 179.503 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.499 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 81.3 t80 -54.96 -63.9 1.01 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.7 177.884 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -63.55 -37.53 87.66 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.813 -173.713 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -81.52 -25.09 36.22 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.811 -173.462 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -130.37 -58.8 1.05 Allowed 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 -174.409 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.499 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 51.2 mm -66.81 -29.05 45.06 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -170.202 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -59.31 144.63 45.89 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.599 -177.506 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 16.9 p -61.63 -58.5 7.84 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.956 0.408 . . . . 0.0 109.928 176.824 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -87.59 85.8 7.13 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 172.083 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -117.03 153.09 49.5 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.932 -175.802 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -74.5 9.58 1.82 Allowed 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 122.811 2.341 . . . . 0.0 112.666 178.59 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.611 ' HE3' ' HA ' ' A' ' 77' ' ' LYS . 0.0 OUTLIER -137.61 -52.59 0.65 Allowed 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 122.457 0.303 . . . . 0.0 110.218 177.568 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 64.81 112.7 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.478 0 O-C-N 123.644 0.59 . . . . 0.0 111.301 -179.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.425 ' C ' ' H ' ' A' ' 81' ' ' LEU . 39.7 t -104.34 142.07 18.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.022 -0.535 . . . . 0.0 109.871 179.445 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -78.19 19.93 0.42 Allowed 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.992 0.425 . . . . 0.0 111.0 -180.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.425 ' H ' ' C ' ' A' ' 79' ' ' VAL . 28.4 tp -60.29 145.05 48.97 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.223 178.058 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -47.51 128.34 12.35 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.236 176.391 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -61.89 -37.1 83.32 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.93 -176.313 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . 0.423 ' O ' HG23 ' A' ' 88' ' ' VAL . 76.7 t60 -66.57 -35.85 81.23 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.664 0.268 . . . . 0.0 110.454 179.112 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 42.4 m -63.7 -44.43 93.7 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.128 0.489 . . . . 0.0 109.826 174.488 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.449 ' O ' HG23 ' A' ' 90' ' ' THR . 57.9 mtpt -62.38 -35.23 78.53 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.98 176.18 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -62.79 -45.08 94.3 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.793 179.738 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.423 HG23 ' O ' ' A' ' 84' ' ' HIS . 74.9 t -58.44 -43.08 85.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.072 0.463 . . . . 0.0 109.981 177.081 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 70.0 mt -68.65 -41.55 82.79 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.248 -177.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.449 HG23 ' O ' ' A' ' 86' ' ' LYS . 43.3 p -62.4 -29.74 70.7 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.837 0.351 . . . . 0.0 111.114 -178.505 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 -85.66 -35.99 20.57 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.032 178.138 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 32.6 t -87.04 -3.46 59.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.438 -0.347 . . . . 0.0 111.485 -176.609 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.1 tp -57.4 -32.3 40.93 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 N-CA-C 111.763 0.283 . . . . 0.0 111.763 -176.436 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 14.6 t -72.98 -31.19 64.37 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 120.739 0.304 . . . . 0.0 110.648 -178.718 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -142.4 79.11 15.9 Favored Pre-proline 0 C--O 1.233 0.19 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 177.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_endo -78.61 157.07 28.35 Favored 'Trans proline' 0 C--O 1.238 0.497 0 C-N-CA 122.614 2.21 . . . . 0.0 112.344 -177.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 41.2 p -85.15 179.69 7.19 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.422 177.224 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 41.0 tp -57.3 -34.23 68.49 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.607 -176.21 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' HIS . . . . . 0.533 ' O ' ' N ' ' A' ' 101' ' ' PHE . 41.9 m-70 -107.44 -28.75 9.64 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 119.622 -0.228 . . . . 0.0 111.15 177.09 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 47.1 t 52.06 -76.6 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 123.197 0.599 . . . . 0.0 111.694 178.102 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.533 ' N ' ' O ' ' A' ' 99' ' ' HIS . 34.7 m-85 -70.58 5.46 1.84 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.217 0.607 . . . . 0.0 110.981 179.542 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . 0.495 ' HB2' ' CB ' ' A' ' 99' ' ' HIS . 12.9 t70 -37.49 -54.49 1.13 Allowed 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.343 0.657 . . . . 0.0 112.249 174.595 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.45 -39.78 80.79 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 121.194 0.521 . . . . 0.0 110.771 -179.533 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.82 -30.73 69.34 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.635 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 21.7 tm0? -58.66 -51.27 70.66 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.623 178.181 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 22.2 m -59.72 -44.62 93.64 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.67 179.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . 0.436 ' O ' ' HG ' ' A' ' 111' ' ' LEU . 25.5 mmt180 -55.16 -62.58 1.57 Allowed 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.123 179.41 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 66.2 t -63.02 -37.53 79.6 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.119 -175.641 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 30.1 t80 -55.06 -53.3 57.57 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.966 179.223 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . 0.409 ' HG3' ' O ' ' A' ' 107' ' ' ARG . 5.2 pp0? -71.6 -28.99 64.19 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 121.177 -0.209 . . . . 0.0 110.998 -176.896 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.436 ' HG ' ' O ' ' A' ' 107' ' ' ARG . 84.5 mt -60.17 -47.62 85.15 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 120.974 0.416 . . . . 0.0 110.219 175.632 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' MET . . . . . 0.444 ' SD ' ' HB ' ' A' ' 41' ' ' ILE . 36.9 mtm -69.56 -37.82 77.18 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.281 178.989 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . 0.637 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 40.2 tt0 -58.73 -61.92 2.25 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.695 -177.434 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -53.95 -28.54 37.99 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 -172.28 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -117.91 -61.92 1.62 Allowed 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 -176.19 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 9.2 m -64.7 -34.49 78.42 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.29 -0.414 . . . . 0.0 112.066 -173.583 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . 0.637 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 17.9 t80 -64.68 -54.45 31.41 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 120.442 0.163 . . . . 0.0 111.308 -175.503 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 14.2 t -61.65 -34.67 76.11 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.021 0.439 . . . . 0.0 110.435 -179.68 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 32.2 ttt180 -69.12 -37.41 78.33 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.864 179.103 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 82.8 t80 -60.0 -41.02 91.18 Favored 'General case' 0 C--N 1.334 -0.094 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.805 175.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 86.9 mt -61.84 -31.54 71.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.561 177.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 15.4 tptm -95.55 -2.65 48.05 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.689 -177.206 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 56.4 p -72.56 159.52 33.76 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 120.741 0.305 . . . . 0.0 110.888 -178.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -55.12 -34.4 63.68 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.106 175.061 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 68.6 mt -59.41 -53.68 44.82 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.231 -178.23 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 70.0 t80 -68.24 -38.96 82.38 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.656 0.265 . . . . 0.0 110.345 -177.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 93.0 mt -61.99 -32.59 73.07 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 120.882 0.372 . . . . 0.0 110.439 177.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -68.39 -35.98 78.48 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.971 176.055 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.445 HD22 HG11 ' A' ' 3' ' ' VAL . 94.0 mt -78.04 -11.93 59.95 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.013 178.899 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' MET . . . . . 0.625 ' HA ' ' HE3' ' A' ' 130' ' ' MET . 4.2 mmt . . . . . 0 C--N 1.331 -0.21 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.867 178.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . 0.443 HG21 ' CH2' ' A' ' 11' ' ' TRP . 3.1 p . . . . . 0 C--O 1.233 0.195 0 CA-C-O 120.758 0.313 . . . . 0.0 110.362 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.0 p -103.36 148.77 36.21 Favored Pre-proline 0 C--N 1.327 -0.383 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 175.096 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_exo -51.78 -24.89 19.36 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 122.836 2.357 . . . . 0.0 112.617 178.355 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.05 -40.92 95.45 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.406 0.622 . . . . 0.0 109.5 176.102 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -74.0 -30.25 62.37 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.803 176.616 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.17 -52.68 61.42 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.727 178.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 27.0 m -65.1 -27.01 41.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.487 177.035 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.54 ' O ' ' HD2' ' A' ' 17' ' ' LYS . 5.0 tppt? -61.71 -46.5 89.41 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 175.84 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . 0.443 ' CH2' HG21 ' A' ' 3' ' ' VAL . 47.9 m0 -59.64 -28.81 67.56 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.44 177.507 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -60.3 -17.23 45.72 Favored Glycine 0 C--N 1.334 0.452 0 CA-C-N 115.602 -0.726 . . . . 0.0 112.465 177.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -76.22 -48.51 20.09 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 120.727 0.299 . . . . 0.0 110.952 177.622 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 38.8 m -146.35 121.71 10.29 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-O 121.064 0.459 . . . . 0.0 112.161 -172.23 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.405 ' O ' HD12 ' A' ' 19' ' ' LEU . 22.4 t80 -52.05 -28.38 17.11 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.093 174.303 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.443 ' HB2' ' HH ' ' A' ' 109' ' ' TYR . 10.4 t70 -54.27 -58.52 7.09 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.454 175.946 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.665 ' HB3' ' HZ3' ' A' ' 17' ' ' LYS . 0.4 OUTLIER -72.15 -16.77 61.98 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.849 -174.058 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 63.0 tp -65.85 -42.91 89.86 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 121.107 0.479 . . . . 0.0 109.764 171.316 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.405 HD12 ' O ' ' A' ' 15' ' ' PHE . 2.7 mp -78.63 -42.43 28.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.529 -176.713 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.549 ' OG ' ' HA ' ' A' ' 17' ' ' LYS . 12.7 p -65.91 -22.94 66.54 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 120.88 0.371 . . . . 0.0 111.091 -178.379 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -82.66 108.92 16.4 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 174.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.5 ptm180 -40.81 -37.33 0.75 Allowed 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.011 0.524 . . . . 0.0 111.806 177.434 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -77.34 -35.31 54.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.133 -178.678 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -68.59 -51.88 28.56 Favored Glycine 0 C--N 1.331 0.259 0 N-CA-C 111.417 -0.673 . . . . 0.0 111.417 179.519 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.7 tt -55.55 -37.4 67.93 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.846 -0.428 . . . . 0.0 109.846 174.233 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.557 ' O ' ' HG3' ' A' ' 30' ' ' ARG . 43.0 tt0 -62.34 -47.82 82.55 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.674 178.709 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -66.57 -40.52 89.01 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.108 0.48 . . . . 0.0 110.327 179.123 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -65.34 -41.53 93.83 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.958 -177.013 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.453 HG23 ' O ' ' A' ' 26' ' ' GLU . 10.4 t -66.36 -36.11 82.05 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 120.559 0.219 . . . . 0.0 110.693 -179.0 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.557 ' HG3' ' O ' ' A' ' 26' ' ' GLU . 49.3 mtt180 -59.27 -43.57 92.48 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 121.17 0.51 . . . . 0.0 110.067 177.166 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.551 ' O ' HG21 ' A' ' 34' ' ' THR . 87.9 t80 -72.81 -46.67 51.91 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.778 -179.819 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 20.8 tp -60.28 -26.37 66.43 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.575 -173.278 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.411 ' NZ ' ' OG1' ' A' ' 29' ' ' THR . 46.5 mttp -66.12 -18.57 65.43 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 112.276 0.473 . . . . 0.0 112.276 -179.522 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.551 HG21 ' O ' ' A' ' 31' ' ' PHE . 5.9 t -77.09 -21.06 54.91 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 120.68 0.276 . . . . 0.0 110.84 -179.171 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -111.66 -7.07 14.28 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.965 -178.654 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 62.02 17.29 8.91 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.87 -0.605 . . . . 0.0 112.036 175.681 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 32.0 t -78.47 6.54 8.31 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.479 0.656 . . . . 0.0 110.128 178.246 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -64.2 -19.16 65.15 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.605 -176.378 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -58.61 -29.08 66.2 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 121.104 0.478 . . . . 0.0 110.178 177.681 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . 0.592 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 90.5 m-20 -73.82 -50.39 20.66 Favored 'General case' 0 C--O 1.242 0.678 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.029 -179.215 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.457 HG13 ' CZ2' ' A' ' 44' ' ' TRP . 13.3 tt -63.96 -42.36 95.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 -179.816 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.531 ' HA ' ' HB ' ' A' ' 45' ' ' ILE . 48.8 mt-10 -65.92 -26.48 67.62 Favored 'General case' 0 N--CA 1.461 0.124 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.77 177.962 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.592 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 37.9 t80 -56.6 -61.35 2.48 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 116.583 -0.28 . . . . 0.0 110.291 175.869 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.457 ' CZ2' HG13 ' A' ' 41' ' ' ILE . 39.9 p-90 -78.68 -18.29 54.61 Favored 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 119.432 -0.907 . . . . 0.0 111.555 -178.072 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.531 ' HB ' ' HA ' ' A' ' 42' ' ' GLU . 24.0 mt -64.13 -37.37 79.7 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.287 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 169.771 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.04 -35.61 81.28 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.7 174.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.819 ' SG ' ' HB2' ' A' ' 101' ' ' PHE . 41.6 t -64.89 -36.09 83.23 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.819 175.131 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.583 ' HA ' ' HB3' ' A' ' 51' ' ' LYS . 15.7 mt-10 -77.95 -25.02 47.98 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 121.009 -0.276 . . . . 0.0 110.56 177.851 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -64.34 -38.56 91.48 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.851 0.834 . . . . 0.0 108.816 171.005 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -64.73 -37.74 88.62 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.405 -1.271 . . . . 0.0 110.102 172.462 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.583 ' HB3' ' HA ' ' A' ' 48' ' ' GLU . 4.7 tmtm? -70.59 -23.1 62.51 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.473 178.65 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.468 ' HG3' ' O ' ' A' ' 48' ' ' GLU . 57.6 mtpt -57.83 -37.11 73.25 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.164 0.507 . . . . 0.0 110.779 177.25 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 10.2 p -91.11 154.26 19.49 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.076 -177.055 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.01 9.66 4.9 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.977 -179.13 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . 0.425 ' O ' HG12 ' A' ' 59' ' ' ILE . . . -83.28 121.23 5.41 Favored Glycine 0 C--N 1.332 0.356 0 N-CA-C 111.465 -0.654 . . . . 0.0 111.465 176.167 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_endo -55.34 -31.7 78.19 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 122.871 2.381 . . . . 0.0 112.768 -174.284 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . 0.503 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 24.6 mp0 -67.12 -51.33 55.36 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 176.897 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 7.9 tp60 -55.27 -38.92 69.2 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.414 179.008 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.425 HG12 ' O ' ' A' ' 55' ' ' GLY . 39.9 mm -52.3 -57.82 3.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.056 179.757 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 70.5 m-70 -64.37 -37.52 87.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.556 -0.293 . . . . 0.0 111.094 -176.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 57' ' ' GLN . 89.0 mt -58.26 -60.9 3.04 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-O 120.865 0.364 . . . . 0.0 110.962 -179.141 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -65.37 -45.24 84.88 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.234 -177.395 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.8 -49.26 77.21 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.82 0.343 . . . . 0.0 111.333 -178.104 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -66.26 -30.77 71.28 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.488 -177.391 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -69.73 -53.98 15.88 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.527 178.375 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 74.3 mt -58.21 -35.49 53.42 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 CA-C-O 121.324 0.583 . . . . 0.0 110.078 177.799 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 85.5 t80 -56.04 -58.27 8.6 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.622 177.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -71.63 -25.42 62.15 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.092 -0.504 . . . . 0.0 112.218 -175.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 65.7 tttp -86.78 -29.02 22.63 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 111.566 0.21 . . . . 0.0 111.566 -176.705 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -127.76 -53.94 1.33 Allowed 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -174.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 45.2 mm -71.51 -19.77 20.69 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 CA-C-O 120.77 0.319 . . . . 0.0 111.575 -171.238 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.46 ' HB3' ' HB1' ' A' ' 75' ' ' ALA . 53.9 tp60 -51.74 135.89 28.5 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.811 178.544 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 19.3 p -50.8 -49.79 57.65 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.942 -176.119 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -85.89 -62.89 1.42 Allowed 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 174.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.46 ' HB1' ' HB3' ' A' ' 72' ' ' GLN . . . 60.09 158.57 0.11 Allowed Pre-proline 0 N--CA 1.469 0.485 0 C-N-CA 122.996 0.518 . . . . 0.0 112.253 176.316 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -70.18 -23.76 28.53 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.218 1.945 . . . . 0.0 111.26 173.097 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -95.81 -41.11 9.0 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.079 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 55.81 88.52 0.04 OUTLIER 'General case' 0 C--O 1.234 0.266 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 -172.142 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 24.3 t -90.91 126.34 43.64 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.683 -172.499 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 37.1 m-80 -74.73 15.89 0.33 Allowed 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.591 -177.442 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.429 ' O ' ' HE2' ' A' ' 86' ' ' LYS . 16.8 tp -57.17 146.97 26.23 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.212 -0.449 . . . . 0.0 109.883 174.734 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -46.89 131.07 12.12 Favored 'General case' 0 C--O 1.237 0.414 0 O-C-N 123.606 0.566 . . . . 0.0 112.39 -176.524 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 36.6 p90 -55.94 -44.98 78.89 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.155 -0.93 . . . . 0.0 111.744 -177.39 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . 0.443 ' O ' HG22 ' A' ' 88' ' ' VAL . 81.1 t60 -67.92 -32.83 73.56 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.83 0.348 . . . . 0.0 110.32 -176.661 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 49.7 m -65.86 -47.19 75.75 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.025 176.696 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.429 ' HE2' ' O ' ' A' ' 81' ' ' LEU . 58.0 mtmt -65.06 -30.72 71.7 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.151 176.959 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -63.52 -50.0 71.31 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.827 179.035 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.443 HG22 ' O ' ' A' ' 84' ' ' HIS . 91.8 t -56.77 -44.91 82.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 121.003 0.43 . . . . 0.0 110.173 178.489 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 70.5 mt -63.22 -47.43 92.3 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.073 -178.768 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 20.2 p -61.64 -26.07 67.77 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 120.763 0.316 . . . . 0.0 111.681 -176.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 42.0 m-80 -94.85 -14.69 24.35 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 111.663 0.245 . . . . 0.0 111.663 178.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 33.0 m -108.45 -4.77 17.03 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 111.664 0.246 . . . . 0.0 111.664 -177.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.444 ' O ' ' HD3' ' A' ' 96' ' ' PRO . 9.6 tp -61.35 -18.72 18.99 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 CA-C-O 120.878 0.371 . . . . 0.0 111.363 -177.757 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.508 HG21 ' HG2' ' A' ' 95' ' ' GLN . 8.9 t -60.72 -29.55 69.43 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.595 177.667 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.508 ' HG2' HG21 ' A' ' 94' ' ' THR . 3.4 pt20 -149.2 77.44 9.05 Favored Pre-proline 0 CA--C 1.532 0.288 0 CA-C-O 121.351 0.596 . . . . 0.0 110.172 178.123 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . 0.444 ' HD3' ' O ' ' A' ' 93' ' ' ILE . 72.3 Cg_endo -73.78 129.76 13.86 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.602 2.201 . . . . 0.0 112.125 -178.033 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 68.7 p -85.04 175.3 9.11 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.29 177.615 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 31.1 tp -60.56 -19.12 56.5 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 121.434 0.635 . . . . 0.0 110.675 -179.118 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' HIS . . . . . 0.779 ' HB3' ' HB2' ' A' ' 102' ' ' ASP . 28.5 m-70 -128.49 39.16 3.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.987 178.226 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 22.4 t -59.41 -30.99 68.86 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.121 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.819 ' HB2' ' SG ' ' A' ' 47' ' ' CYS . 59.0 m-85 -104.38 19.74 19.72 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.578 -178.704 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . 0.779 ' HB2' ' HB3' ' A' ' 99' ' ' HIS . 24.2 t70 -58.88 -43.07 90.84 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.265 -175.786 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.453 ' O ' ' HG2' ' A' ' 107' ' ' ARG . . . -68.66 -41.29 79.51 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.105 179.232 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -58.42 -39.9 81.05 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.166 178.035 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.456 ' HG2' ' HB2' ' A' ' 44' ' ' TRP . 23.0 tm0? -57.54 -51.27 70.15 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.769 177.833 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 36.3 t -63.61 -37.08 85.98 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.159 -178.102 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . 0.517 ' O ' ' HG ' ' A' ' 111' ' ' LEU . 12.3 mmm180 -67.25 -46.88 72.41 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.504 0.192 . . . . 0.0 111.095 -178.553 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 61.4 t -68.85 -34.99 67.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 121.348 0.594 . . . . 0.0 109.927 177.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . 0.443 ' HH ' ' HB2' ' A' ' 16' ' ' ASP . 2.6 t80 -55.49 -51.75 65.94 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.548 175.087 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . 0.479 ' O ' ' HG2' ' A' ' 114' ' ' GLN . 3.9 pt20 -69.68 -29.67 67.16 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.068 -177.819 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 107' ' ' ARG . 80.9 mt -63.02 -43.55 98.42 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 120.907 0.384 . . . . 0.0 110.465 177.295 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 43.5 mtm -74.27 -28.52 61.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.024 0.44 . . . . 0.0 110.06 177.605 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . 0.581 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 8.2 tm-20 -60.28 -65.48 0.68 Allowed 'General case' 0 C--O 1.236 0.373 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.333 179.211 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . 0.479 ' HG2' ' O ' ' A' ' 110' ' ' GLN . 14.6 pt20 -56.22 -28.7 59.33 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 -174.468 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -105.91 -62.38 1.38 Allowed 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -176.473 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 12.9 m -75.93 -37.95 58.17 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 111.933 0.345 . . . . 0.0 111.933 -173.346 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . 0.581 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 25.6 t80 -72.83 -40.43 65.77 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.775 -0.193 . . . . 0.0 111.136 -174.328 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 24.6 p -57.57 -53.22 60.68 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-O 121.368 0.604 . . . . 0.0 109.851 175.653 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . 0.423 HH11 ' HD3' ' A' ' 119' ' ' ARG . 28.9 mtp-105 -58.75 -38.47 78.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.007 177.119 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -61.6 -39.18 90.31 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.735 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.476 HD11 ' CZ ' ' A' ' 117' ' ' TYR . 82.4 mt -70.09 -27.24 64.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.816 0.341 . . . . 0.0 110.88 179.167 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . 0.743 ' HE3' ' HA ' ' A' ' 122' ' ' LYS . 0.2 OUTLIER -100.41 1.49 41.37 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.112 -178.979 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 83.5 p -64.68 148.14 51.62 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 120.778 0.323 . . . . 0.0 110.838 -177.587 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -63.06 -35.28 79.71 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.523 -178.602 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 6.4 tp -64.12 -40.37 88.8 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.864 178.002 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 83.2 t80 -60.34 -43.09 96.77 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.145 0.498 . . . . 0.0 109.893 178.28 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 69.4 mt -66.12 -31.52 72.42 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.436 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -64.84 -38.77 92.09 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.997 176.676 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 86.6 mt -61.7 -40.71 95.98 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.927 175.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' MET . . . . . . . . . . . . . 86.9 mmm . . . . . 0 C--O 1.234 0.24 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.412 179.45 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.5 p . . . . . 0 CA--C 1.531 0.226 0 CA-C-O 120.699 0.285 . . . . 0.0 111.239 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.0 m -86.72 148.25 45.62 Favored Pre-proline 0 CA--C 1.534 0.33 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 175.286 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -53.63 -30.63 56.27 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.743 2.295 . . . . 0.0 113.04 -173.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 28.5 tp10 -60.52 -43.15 97.45 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 121.173 0.511 . . . . 0.0 110.303 177.155 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -76.55 -32.5 58.24 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.944 179.478 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.14 -49.91 70.28 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.848 179.19 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 33.7 m -66.9 -28.34 42.69 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 177.539 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.548 ' O ' ' HD2' ' A' ' 17' ' ' LYS . 8.4 tppt? -57.85 -48.85 78.59 Favored 'General case' 0 CA--C 1.527 0.094 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.388 176.523 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . 0.429 ' HB3' HD11 ' A' ' 18' ' ' LEU . 49.1 m0 -59.54 -33.11 70.97 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.505 178.224 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -69.11 -8.18 58.07 Favored Glycine 0 C--N 1.331 0.281 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.903 -178.607 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -79.37 -34.14 42.29 Favored 'General case' 0 C--N 1.33 -0.248 0 O-C-N 122.839 -0.212 . . . . 0.0 110.618 177.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.477 ' HB3' ' HG2' ' A' ' 17' ' ' LYS . 35.5 t -161.0 129.26 4.43 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 120.996 0.427 . . . . 0.0 111.56 -176.01 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.437 ' O ' HD12 ' A' ' 19' ' ' LEU . 10.1 t80 -58.23 -27.61 64.1 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.597 175.775 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -60.78 -48.71 80.56 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.048 177.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.548 ' HD2' ' O ' ' A' ' 10' ' ' LYS . 19.3 ptpt -80.19 -11.74 59.71 Favored 'General case' 0 C--O 1.233 0.192 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.796 -177.007 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.429 HD11 ' HB3' ' A' ' 11' ' ' TRP . 60.0 tp -69.0 -45.93 69.32 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 170.411 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.437 HD12 ' O ' ' A' ' 15' ' ' PHE . 8.0 mp -61.83 -30.31 70.75 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.839 176.268 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.4 t -58.12 -21.13 45.19 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.168 178.439 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -102.41 136.5 42.12 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 176.634 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.03 -47.56 50.89 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 121.137 0.494 . . . . 0.0 110.098 177.329 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 30.2 p-10 -69.78 -33.9 73.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.277 178.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -64.14 -45.5 93.57 Favored Glycine 0 C--N 1.333 0.377 0 N-CA-C 111.388 -0.685 . . . . 0.0 111.388 173.363 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.5 tp -53.38 -52.4 59.41 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.365 0.603 . . . . 0.0 110.158 174.067 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.637 ' O ' ' HG2' ' A' ' 30' ' ' ARG . 27.9 tt0 -60.33 -42.4 95.56 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.514 -177.663 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -55.21 -47.3 75.51 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-O 121.28 0.562 . . . . 0.0 110.134 177.669 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 90.6 t80 -59.92 -49.09 79.04 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.633 178.236 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.552 HG22 ' HA ' ' A' ' 26' ' ' GLU . 6.0 t -65.88 -24.57 66.88 Favored 'General case' 0 C--O 1.225 -0.211 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.571 -177.243 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.637 ' HG2' ' O ' ' A' ' 26' ' ' GLU . 31.5 mmt180 -57.56 -48.96 77.91 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 173.391 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.585 ' O ' HG22 ' A' ' 34' ' ' THR . 86.5 t80 -69.73 -33.83 73.02 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.655 178.434 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.449 HD21 ' HB ' ' A' ' 41' ' ' ILE . 27.5 tp -72.71 -26.19 61.5 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 121.005 0.431 . . . . 0.0 110.916 -178.241 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.497 ' HG3' ' O ' ' A' ' 29' ' ' THR . 28.2 mtpp -75.4 -38.29 59.97 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.091 179.652 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.585 HG22 ' O ' ' A' ' 31' ' ' PHE . 12.0 t -68.18 -15.96 63.79 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 120.804 0.335 . . . . 0.0 110.825 -176.689 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -109.55 23.78 13.97 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.265 175.437 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 50.4 p90 45.12 26.24 0.22 Allowed 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.603 1.161 . . . . 0.0 113.587 174.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 10.4 t -108.04 20.13 19.11 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.043 0.449 . . . . 0.0 110.193 -179.219 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.618 ' O ' HG23 ' A' ' 41' ' ' ILE . 10.2 pt-20 -63.34 -22.44 66.88 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.564 -176.603 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -53.02 -26.37 15.3 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.662 0.268 . . . . 0.0 111.263 -179.584 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . 0.418 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 8.4 m120 -67.12 -49.7 63.99 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-O 121.047 0.451 . . . . 0.0 110.447 177.761 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.618 HG23 ' O ' ' A' ' 38' ' ' GLU . 6.3 tp -63.85 -42.75 96.87 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.122 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.197 -176.555 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -71.63 -25.84 62.32 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.26 -178.193 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.436 ' HE1' ' HB3' ' A' ' 70' ' ' PHE . 41.3 t80 -60.57 -67.86 0.36 Allowed 'General case' 0 C--O 1.237 0.412 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.969 179.483 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.515 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 35.6 p-90 -75.96 -23.57 55.36 Favored 'General case' 0 C--O 1.225 -0.187 0 C-N-CA 119.402 -0.919 . . . . 0.0 111.954 -174.821 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 26.4 mt -57.9 -38.67 67.58 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 C-N-CA 120.405 -0.518 . . . . 0.0 109.769 172.237 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.03 -37.24 85.39 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 121.137 0.494 . . . . 0.0 110.034 175.19 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.564 ' O ' ' HB3' ' A' ' 50' ' ' PHE . 71.6 m -72.15 -17.17 61.98 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.297 177.685 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.515 ' HG2' ' O ' ' A' ' 44' ' ' TRP . 12.3 mm-40 -73.98 -37.36 64.48 Favored 'General case' 0 C--O 1.225 -0.22 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 171.286 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.448 ' O ' ' HB2' ' A' ' 52' ' ' LYS . 5.8 m-20 -59.12 -29.77 67.64 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 172.149 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.564 ' HB3' ' O ' ' A' ' 47' ' ' CYS . 85.2 t80 -64.43 -40.61 96.08 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.971 173.875 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.553 ' HE3' ' CE1' ' A' ' 99' ' ' HIS . 60.0 mttp -58.87 -31.78 68.87 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.091 0.472 . . . . 0.0 110.236 173.552 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.554 ' N ' ' HE2' ' A' ' 52' ' ' LYS . 1.1 mpmm? -70.1 -24.73 63.25 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.419 -179.851 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.462 ' HB3' ' HG3' ' A' ' 58' ' ' GLN . 39.1 m -60.73 127.42 31.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.714 0.768 . . . . 0.0 110.963 -177.289 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 28.5 tptp -110.58 128.7 55.77 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 114.647 -1.161 . . . . 0.0 110.152 -176.072 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 100.68 131.64 7.46 Favored Glycine 0 CA--C 1.519 0.282 0 N-CA-C 111.701 -0.56 . . . . 0.0 111.701 -178.292 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . 0.466 ' O ' ' HD2' ' A' ' 60' ' ' HIS . 12.1 Cg_endo -54.54 -46.52 32.84 Favored 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 122.794 2.329 . . . . 0.0 111.847 -178.492 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -53.7 -48.0 69.96 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.058 0.456 . . . . 0.0 110.282 178.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.462 ' HG3' ' HB3' ' A' ' 53' ' ' SER . 8.4 tp-100 -55.57 -42.77 75.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.121 177.033 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.524 HG22 ' HG2' ' A' ' 96' ' ' PRO . 47.5 mm -60.85 -39.9 83.44 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.024 179.334 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.466 ' HD2' ' O ' ' A' ' 56' ' ' PRO . 74.2 m-70 -61.93 -55.02 33.84 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 120.673 0.273 . . . . 0.0 110.854 -179.207 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.529 HD13 ' N ' ' A' ' 62' ' ' LYS . 4.2 pp -67.69 -35.66 79.23 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.357 -176.217 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.529 ' N ' HD13 ' A' ' 61' ' ' LEU . 32.0 mmtp -65.67 -38.8 90.31 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 120.946 0.403 . . . . 0.0 110.005 176.363 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.83 -49.03 79.13 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.751 179.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 53.7 mmtt -54.26 -43.07 70.64 Favored 'General case' 0 N--CA 1.466 0.351 0 O-C-N 123.273 0.358 . . . . 0.0 111.191 178.256 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.02 -61.07 2.55 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.064 -179.895 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 63.9 mt -64.08 -37.6 80.27 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-O 121.334 0.588 . . . . 0.0 110.586 -178.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -57.24 -57.39 12.84 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.179 -177.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -78.15 -23.04 47.9 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.919 -172.796 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -99.76 -16.82 17.98 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -174.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . 0.436 ' HB3' ' HE1' ' A' ' 43' ' ' PHE . 97.3 m-85 -132.56 -49.17 0.9 Allowed 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 -176.405 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 50.6 mm -74.89 -32.51 27.88 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -169.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 51.2 mm-40 -64.67 143.44 57.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.98 0.419 . . . . 0.0 111.556 179.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 22.1 m -62.46 -28.94 70.17 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.212 177.223 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -98.47 24.43 7.38 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.501 -178.211 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.413 ' C ' ' H ' ' A' ' 77' ' ' LYS . . . -89.57 152.31 47.03 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.58 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_exo -67.34 15.81 0.13 Allowed 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 123.248 2.632 . . . . 0.0 113.732 -177.165 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.413 ' H ' ' C ' ' A' ' 75' ' ' ALA . 0.0 OUTLIER -130.4 -27.21 2.21 Favored 'General case' 0 C--N 1.331 -0.238 0 O-C-N 122.333 -0.229 . . . . 0.0 111.236 177.852 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 48.73 42.21 19.27 Favored 'General case' 0 N--CA 1.466 0.353 0 O-C-N 123.498 0.499 . . . . 0.0 110.937 177.055 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 58.3 t -47.47 133.34 4.42 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 CA-C-N 115.264 -0.88 . . . . 0.0 111.848 -174.653 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.463 ' N ' HD21 ' A' ' 80' ' ' ASN . 0.9 OUTLIER -70.84 76.46 0.62 Allowed 'General case' 0 C--O 1.237 0.413 0 CA-C-O 121.283 0.563 . . . . 0.0 110.911 -178.558 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.542 HD23 ' HB3' ' A' ' 86' ' ' LYS . 55.2 tp -113.79 144.68 42.59 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.32 -0.854 . . . . 0.0 109.918 177.075 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -67.2 145.73 54.92 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 120.815 0.341 . . . . 0.0 110.91 178.644 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 91.7 t80 -58.32 -50.85 72.16 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.465 -176.602 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . 0.427 ' O ' ' HB3' ' A' ' 87' ' ' GLU . 85.7 t60 -61.14 -33.26 73.12 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.615 0.245 . . . . 0.0 111.176 -175.61 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 25.7 m -69.03 -50.13 51.43 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.805 0.336 . . . . 0.0 110.79 178.671 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.542 ' HB3' HD23 ' A' ' 81' ' ' LEU . 12.2 ptmm? -70.69 -19.96 62.73 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.084 0.468 . . . . 0.0 110.295 178.645 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.427 ' HB3' ' O ' ' A' ' 84' ' ' HIS . 37.1 tt0 -61.84 -54.77 37.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.613 173.6 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.415 HG22 ' O ' ' A' ' 84' ' ' HIS . 59.2 t -55.01 -41.24 57.65 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.215 178.077 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 73.2 mt -60.15 -53.21 51.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.118 179.722 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.502 HG22 ' O ' ' A' ' 86' ' ' LYS . 66.7 p -58.48 -30.57 67.1 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 120.799 0.333 . . . . 0.0 111.596 -176.173 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 41.8 m-80 -83.53 -29.56 27.79 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.492 -179.521 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 16.1 m -101.14 -0.99 35.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.711 0.291 . . . . 0.0 111.4 -175.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.5 tp -61.97 -21.2 25.61 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-O 120.851 0.358 . . . . 0.0 111.357 -176.65 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 9.5 t -62.64 -37.83 87.89 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.623 179.255 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -138.83 77.15 33.14 Favored Pre-proline 0 C--O 1.234 0.272 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.259 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . 0.524 ' HG2' HG22 ' A' ' 59' ' ' ILE . 72.8 Cg_endo -76.92 151.76 31.43 Favored 'Trans proline' 0 C--O 1.235 0.374 0 C-N-CA 122.649 2.232 . . . . 0.0 112.102 -178.173 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 5.8 m -96.43 168.71 10.39 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 116.035 -0.529 . . . . 0.0 109.823 178.353 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 61.1 tp -45.79 -36.61 5.29 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 -175.275 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' HIS . . . . . 0.767 ' HB3' ' HB2' ' A' ' 102' ' ' ASP . 55.1 m-70 -98.13 -52.5 3.67 Favored 'General case' 0 N--CA 1.464 0.242 0 O-C-N 122.25 -0.281 . . . . 0.0 110.852 -179.255 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 33.2 t 51.5 -81.94 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.105 0.562 . . . . 0.0 112.507 174.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . 0.444 ' N ' ' O ' ' A' ' 99' ' ' HIS . 50.4 m-85 -74.55 -1.55 21.91 Favored 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 122.635 0.374 . . . . 0.0 111.287 -174.981 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . 0.767 ' HB2' ' HB3' ' A' ' 99' ' ' HIS . 8.0 t70 -51.52 -43.53 62.3 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.44 -176.205 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.33 -41.29 88.8 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 121.256 0.551 . . . . 0.0 110.373 177.269 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.09 -36.35 83.73 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.348 178.181 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.449 ' OE1' ' SG ' ' A' ' 47' ' ' CYS . 15.9 mm-40 -66.38 -36.84 83.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.449 179.583 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 52.0 m -62.06 -35.4 78.51 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.573 177.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . 0.503 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 0.0 OUTLIER -60.69 -49.47 77.4 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-O 121.025 0.441 . . . . 0.0 110.06 178.228 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.48 HG13 ' SD ' ' A' ' 112' ' ' MET . 96.7 t -64.28 -46.0 94.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.285 178.022 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -52.5 -47.06 66.82 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.601 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . 0.503 ' HG3' ' O ' ' A' ' 107' ' ' ARG . 0.0 OUTLIER -70.64 -31.06 67.85 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 121.139 -0.224 . . . . 0.0 110.773 -176.077 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.494 ' HA ' HE21 ' A' ' 114' ' ' GLN . 95.2 mt -62.58 -49.0 77.0 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.482 0.658 . . . . 0.0 109.339 172.831 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' MET . . . . . 0.48 ' SD ' HG13 ' A' ' 108' ' ' VAL . 66.0 mtp -60.42 -38.17 83.21 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.296 178.811 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . 0.605 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 39.7 tt0 -61.23 -65.72 0.65 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.718 -178.825 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . 0.494 HE21 ' HA ' ' A' ' 111' ' ' LEU . 27.2 pt20 -60.93 -32.34 71.84 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.861 -174.426 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -90.4 -70.29 0.68 Allowed 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 -177.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 4.7 p -86.28 -25.01 25.72 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 -169.115 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . 0.605 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 38.2 t80 -71.55 -41.08 69.55 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 118.398 0.545 . . . . 0.0 110.659 -178.407 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 31.6 p -60.35 -51.99 67.17 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 121.321 0.581 . . . . 0.0 110.141 176.799 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 43.2 mtm-85 -59.03 -36.04 74.31 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.445 177.434 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 65.7 t80 -62.78 -38.09 89.25 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.616 177.442 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 82.5 mt -65.35 -27.22 68.43 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.788 0.327 . . . . 0.0 110.641 178.583 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . 0.78 ' HE2' ' HA ' ' A' ' 122' ' ' LYS . 10.4 mmpt? -102.6 1.83 35.28 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.784 178.729 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' SER . . . . . 0.451 ' OG ' HG22 ' A' ' 125' ' ' ILE . 79.0 p -72.96 143.16 47.74 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.749 0.309 . . . . 0.0 110.707 -179.352 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -59.99 -25.98 65.69 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.213 178.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.461 HD11 ' O ' ' A' ' 125' ' ' ILE . 0.0 OUTLIER -67.27 -36.64 77.27 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 177.854 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 84.0 t80 -64.61 -38.45 91.06 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 121.068 0.461 . . . . 0.0 109.913 174.696 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.498 HD12 ' HG3' ' A' ' 130' ' ' MET . 4.4 mm? -65.17 -22.59 66.93 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.751 177.027 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -73.9 -33.44 64.0 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 121.193 0.521 . . . . 0.0 109.683 173.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 66.9 mt -72.76 -23.38 60.81 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.796 178.09 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' MET . . . . . 0.544 ' HA ' ' HE3' ' A' ' 130' ' ' MET . 2.4 mmt . . . . . 0 CA--C 1.529 0.163 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.954 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.2 p . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.776 0.322 . . . . 0.0 110.885 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 49.8 m -80.02 141.87 55.11 Favored Pre-proline 0 C--O 1.236 0.349 0 CA-C-N 116.148 -0.478 . . . . 0.0 109.996 176.136 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -51.39 -35.01 52.91 Favored 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 122.804 2.336 . . . . 0.0 112.898 -177.14 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.511 ' O ' ' HG2' ' A' ' 10' ' ' LYS . 14.5 mm-40 -69.0 -34.68 75.67 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.991 -179.359 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 23.4 mm-40 -71.44 -32.79 68.75 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 172.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.35 -42.81 98.95 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.706 178.944 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.465 HG23 ' O ' ' A' ' 6' ' ' GLU . 17.4 m -69.71 -28.31 36.79 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-O 120.98 0.419 . . . . 0.0 110.087 176.914 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.524 ' HA ' ' HG2' ' A' ' 13' ' ' GLU . 71.6 mmtt -66.56 -31.06 71.53 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.368 174.981 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . 0.436 ' CD1' ' HG2' ' A' ' 17' ' ' LYS . 48.2 m0 -62.24 -25.75 68.0 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 173.183 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -79.85 -22.99 62.76 Favored Glycine 0 C--N 1.333 0.405 0 CA-C-N 115.565 -0.743 . . . . 0.0 112.927 -178.551 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.524 ' HG2' ' HA ' ' A' ' 10' ' ' LYS . 8.2 pt-20 -101.88 -18.07 15.89 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.821 0.31 . . . . 0.0 110.871 178.278 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 42.1 m -134.8 96.97 3.65 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.893 0.377 . . . . 0.0 111.519 -177.779 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -58.28 -34.13 70.18 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 175.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -54.55 -48.94 71.41 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.802 174.367 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.436 ' HG2' ' CD1' ' A' ' 11' ' ' TRP . 22.0 ttmm -67.22 -35.24 79.17 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.8 -177.494 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 67.1 tp -57.63 -49.58 75.96 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.066 -0.516 . . . . 0.0 109.924 176.453 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.5 mp -73.45 -30.26 63.08 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.966 179.748 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 26.0 t -63.73 -41.12 98.11 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.194 179.666 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 21.1 m-70 -77.49 115.88 17.61 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 175.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.401 ' HD2' ' N ' ' A' ' 22' ' ' ARG . 8.3 mpt_? -53.15 -35.26 59.56 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 120.86 0.362 . . . . 0.0 110.667 -177.852 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -66.25 -42.99 87.76 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.378 177.521 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -65.68 -50.51 53.66 Favored Glycine 0 C--N 1.335 0.483 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.877 179.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 11.5 tp -47.83 -51.59 22.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.367 0.603 . . . . 0.0 110.584 174.514 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.507 ' O ' ' HG3' ' A' ' 30' ' ' ARG . 12.8 tp10 -65.03 -40.25 94.56 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.77 -176.7 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.07 -41.76 98.5 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.046 0.451 . . . . 0.0 110.629 178.281 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 83.5 t80 -71.71 -45.57 61.4 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.152 -176.201 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.632 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 9.0 t -60.79 -45.27 95.05 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 120.937 -0.305 . . . . 0.0 110.399 -177.788 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.507 ' HG3' ' O ' ' A' ' 26' ' ' GLU . 73.8 mtt-85 -58.92 -40.48 84.67 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.017 0.437 . . . . 0.0 109.988 178.361 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.516 ' O ' HG21 ' A' ' 34' ' ' THR . 94.5 t80 -63.92 -30.88 71.93 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.479 177.549 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.445 HD23 HG23 ' A' ' 41' ' ' ILE . 18.9 tp -85.72 -20.11 29.82 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.464 -179.028 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.632 ' HG3' ' O ' ' A' ' 29' ' ' THR . 66.1 mttm -77.6 -36.14 52.11 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.018 178.951 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.516 HG21 ' O ' ' A' ' 31' ' ' PHE . 14.8 t -63.81 -29.96 71.1 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 120.884 0.373 . . . . 0.0 110.972 -177.919 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -91.99 2.77 56.34 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.412 177.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 89.9 m-85 55.96 47.22 20.41 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.318 179.176 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 20.3 t -131.17 15.17 5.14 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.466 176.188 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.423 ' HB2' ' OE1' ' A' ' 42' ' ' GLU . 0.1 OUTLIER -57.16 -24.25 53.06 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 115.172 -0.922 . . . . 0.0 111.199 -179.374 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.432 ' O ' ' HB2' ' A' ' 43' ' ' PHE . 11.4 pt-20 -40.13 -36.06 0.46 Allowed 'General case' 0 C--O 1.225 -0.236 0 CA-C-N 115.205 -0.907 . . . . 0.0 112.161 178.442 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . 0.441 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 46.5 m-80 -66.95 -62.17 1.57 Allowed 'General case' 0 C--O 1.245 0.816 0 CA-C-O 121.07 0.462 . . . . 0.0 111.528 -176.833 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.512 HD13 ' HB ' ' A' ' 29' ' ' THR . 13.1 tt -62.43 -44.09 98.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.194 -176.608 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.423 ' OE1' ' HB2' ' A' ' 38' ' ' GLU . 0.9 OUTLIER -63.17 -31.5 72.66 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.071 177.365 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.441 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 76.3 t80 -55.93 -60.77 2.99 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 120.706 0.288 . . . . 0.0 110.828 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.516 ' HB2' ' HG3' ' A' ' 105' ' ' GLN . 28.6 p-90 -78.05 -11.16 59.89 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 119.722 -0.791 . . . . 0.0 111.929 -176.15 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.487 HG13 ' O ' ' A' ' 41' ' ' ILE . 54.2 mt -68.66 -39.68 80.68 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 168.2 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.55 -32.37 73.99 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.898 174.157 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.402 ' O ' ' HB3' ' A' ' 50' ' ' PHE . 43.4 t -66.54 -28.78 68.81 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.583 175.792 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.51 ' O ' ' HG3' ' A' ' 51' ' ' LYS . 4.3 tm-20 -72.81 -40.08 66.13 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 177.134 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -65.04 -33.75 76.79 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.821 174.575 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . 0.402 ' HB3' ' O ' ' A' ' 47' ' ' CYS . 74.0 t80 -60.67 -58.73 7.23 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.901 177.017 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.51 ' HG3' ' O ' ' A' ' 48' ' ' GLU . 0.0 OUTLIER -63.29 -20.75 65.76 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 116.615 -0.266 . . . . 0.0 111.491 -179.139 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -72.05 -26.81 62.33 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.893 0.378 . . . . 0.0 110.685 177.216 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 42.7 m -66.65 106.86 1.93 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.996 -177.124 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.24 -4.84 56.95 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.929 179.788 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -80.43 117.04 4.37 Favored Glycine 0 CA--C 1.52 0.373 0 N-CA-C 111.529 -0.628 . . . . 0.0 111.529 175.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -50.82 -46.53 29.86 Favored 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 122.921 2.414 . . . . 0.0 112.687 -177.191 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 7.3 pm0 -71.57 -33.2 68.89 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.037 0.446 . . . . 0.0 109.946 179.562 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -62.2 -36.62 82.47 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.981 -177.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . 0.414 HG22 ' HG2' ' A' ' 96' ' ' PRO . 71.5 mt -53.89 -43.62 57.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.471 176.789 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 68.7 m-70 -63.66 -43.88 95.43 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.192 178.784 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 53.6 mt -64.59 -49.37 71.4 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.138 -175.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -56.48 -50.87 70.5 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.205 179.151 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.97 -41.64 98.24 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.049 -179.686 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 50.5 tptt -59.53 -45.33 92.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.463 -179.534 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.18 -56.18 21.26 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.636 179.099 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 71.0 mt -57.67 -37.08 57.18 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.481 -179.461 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.43 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 86.1 t80 -58.38 -60.82 3.19 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.54 -179.446 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -82.87 -1.05 50.99 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.911 -171.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 57.5 tptt -105.82 -31.76 8.69 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.748 -0.206 . . . . 0.0 111.008 178.238 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 81.2 m-85 -130.01 -43.5 1.2 Allowed 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 -172.242 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . 0.43 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 48.2 mm -77.93 -32.88 17.92 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 CA-C-O 121.046 0.451 . . . . 0.0 111.711 -173.477 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.545 ' HB3' ' HB1' ' A' ' 75' ' ' ALA . 7.0 tp60 -77.02 144.49 38.62 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.196 -173.824 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 89.4 m -71.64 -34.98 70.24 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.826 -178.37 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -87.73 10.58 17.82 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 120.91 0.386 . . . . 0.0 110.747 177.21 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.545 ' HB1' ' HB3' ' A' ' 72' ' ' GLN . . . -69.91 154.11 94.93 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.528 179.15 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -55.18 -28.69 62.66 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.668 2.245 . . . . 0.0 112.25 178.536 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 17.9 tppt? -107.3 -69.51 0.84 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.488 -178.095 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 63.07 108.17 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.273 0.559 . . . . 0.0 110.023 -170.48 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 48.9 t -93.9 155.61 3.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.357 -176.515 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.459 ' HB2' HD22 ' A' ' 111' ' ' LEU . 45.0 m-80 -78.02 48.45 0.72 Allowed 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.238 0.542 . . . . 0.0 110.8 -179.746 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.412 HD13 HG22 ' A' ' 85' ' ' THR . 23.4 tp -79.45 151.7 30.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.382 179.291 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -53.88 137.53 38.54 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.827 -179.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 28.8 p90 -59.02 -45.75 89.94 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.438 -176.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 83.3 t60 -69.9 -30.83 68.36 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.764 0.316 . . . . 0.0 110.675 -176.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.412 HG22 HD13 ' A' ' 81' ' ' LEU . 39.3 m -64.8 -50.28 67.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.434 179.484 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.415 ' O ' HG21 ' A' ' 90' ' ' THR . 16.0 ptpt -71.66 -24.1 61.79 Favored 'General case' 0 CA--C 1.527 0.077 0 C-N-CA 120.76 -0.376 . . . . 0.0 110.713 -179.568 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -55.52 -53.88 50.83 Favored 'General case' 0 N--CA 1.462 0.161 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 173.512 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 53.1 t -56.77 -45.61 83.03 Favored 'Isoleucine or valine' 0 C--O 1.234 0.254 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.328 178.016 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 71.9 mt -59.4 -47.64 89.92 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.21 -178.527 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' THR . . . . . 0.415 HG21 ' O ' ' A' ' 86' ' ' LYS . 66.6 p -62.83 -27.06 69.06 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 120.867 0.365 . . . . 0.0 111.052 -178.173 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 82.3 m-20 -90.87 -14.2 32.21 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.459 -179.033 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 14.4 m -118.04 -0.01 11.74 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 111.804 0.298 . . . . 0.0 111.804 -176.071 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 7.8 tp -59.9 -23.26 26.19 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 CA-C-O 120.802 0.334 . . . . 0.0 111.337 -177.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' THR . . . . . 0.536 HG23 ' HG2' ' A' ' 95' ' ' GLN . 5.9 t -59.79 -32.71 70.86 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.855 178.749 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.536 ' HG2' HG23 ' A' ' 94' ' ' THR . 11.7 pt20 -165.05 93.02 0.92 Allowed Pre-proline 0 CA--C 1.533 0.32 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.051 177.443 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . 0.414 ' HG2' HG22 ' A' ' 59' ' ' ILE . 94.2 Cg_endo -81.8 158.24 18.61 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.82 2.347 . . . . 0.0 112.594 -178.719 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 25.0 p -84.28 173.83 10.66 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.955 177.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -49.62 -43.77 46.85 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 123.208 0.603 . . . . 0.0 112.485 -172.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 -129.11 28.74 5.25 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.208 -173.588 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 6.3 p -46.09 -36.15 5.56 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 112.967 0.729 . . . . 0.0 112.967 -173.685 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -82.06 18.81 1.26 Allowed 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -177.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -70.64 -37.76 73.78 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 121.13 0.49 . . . . 0.0 109.899 179.028 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . 0.428 ' O ' ' HG2' ' A' ' 107' ' ' ARG . . . -61.72 -46.04 91.38 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.724 175.448 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.28 -40.99 96.16 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.493 178.278 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.516 ' HG3' ' HB2' ' A' ' 44' ' ' TRP . 30.4 tt0 -57.83 -45.82 85.63 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.621 177.663 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 18.5 m -63.27 -43.64 97.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.83 -179.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . 0.428 ' HG2' ' O ' ' A' ' 103' ' ' ALA . 20.5 mmt180 -58.14 -53.51 57.49 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.917 179.207 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.437 ' O ' ' SD ' ' A' ' 112' ' ' MET . 99.5 t -69.11 -35.9 70.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.457 -175.794 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . 0.463 ' HA ' ' HE1' ' A' ' 112' ' ' MET . 67.7 t80 -53.8 -54.55 36.72 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.031 0.444 . . . . 0.0 110.826 179.092 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 26.6 pt20 -73.85 -20.15 60.52 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.829 179.235 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . 0.459 HD22 ' HB2' ' A' ' 80' ' ' ASN . 35.6 tp -61.58 -49.66 75.74 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.257 -176.814 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' MET . . . . . 0.463 ' HE1' ' HE1' ' A' ' 44' ' ' TRP . 0.0 OUTLIER -83.5 -29.63 27.81 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 120.312 -0.555 . . . . 0.0 110.263 177.529 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . 0.631 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 40.1 tt0 -52.36 -53.38 45.49 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 120.936 0.398 . . . . 0.0 110.721 179.188 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . 0.4 ' HG2' ' O ' ' A' ' 111' ' ' LEU . 29.8 pt20 -52.58 -18.95 1.98 Allowed 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 113.623 0.971 . . . . 0.0 113.623 -170.638 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . 0.578 ' O ' ' HG3' ' A' ' 119' ' ' ARG . 35.5 t70 -141.84 -52.86 0.43 Allowed 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 118.087 0.403 . . . . 0.0 111.68 -178.715 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 22.6 m -59.83 -31.76 70.03 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 120.665 0.269 . . . . 0.0 111.252 -178.801 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . 0.631 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 16.1 t80 -71.4 -42.75 67.94 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-O 120.647 0.261 . . . . 0.0 110.451 179.795 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 7.8 p -65.99 -35.54 80.87 Favored 'General case' 0 C--O 1.24 0.585 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.635 178.509 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . 0.578 ' HG3' ' O ' ' A' ' 115' ' ' ASP . 95.4 mtt180 -54.42 -51.13 65.9 Favored 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 172.266 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 79.6 t80 -58.39 -38.67 77.78 Favored 'General case' 0 C--O 1.225 -0.211 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.42 179.257 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 68.4 mt -62.95 -23.34 67.36 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.595 -179.272 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 2.4 tppp? -118.69 12.27 13.01 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.099 0.476 . . . . 0.0 111.311 177.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 95.2 p -71.17 146.81 48.88 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 176.245 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -56.48 -30.39 62.88 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 176.752 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . 0.413 ' O ' ' HG ' ' A' ' 129' ' ' LEU . 78.5 mt -56.94 -54.51 29.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-N 115.138 -0.937 . . . . 0.0 110.335 175.712 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' TYR . . . . . 0.473 ' O ' ' HG2' ' A' ' 130' ' ' MET . 75.7 t80 -64.1 -38.23 90.3 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.442 -178.888 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 92.4 mt -61.87 -36.1 80.25 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.166 177.535 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -70.6 -32.51 69.9 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.112 176.841 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 125' ' ' ILE . 95.9 mt -72.29 -26.82 62.11 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.503 176.43 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' MET . . . . . 0.633 ' HA ' ' HE3' ' A' ' 130' ' ' MET . 27.2 mmt . . . . . 0 C--O 1.232 0.167 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 176.089 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . 0.477 HG21 ' CH2' ' A' ' 11' ' ' TRP . 2.6 p . . . . . 0 CA--C 1.529 0.136 0 CA-C-O 120.825 0.345 . . . . 0.0 110.973 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 34.4 m -114.6 155.75 45.65 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.645 177.117 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 80.5 Cg_exo -49.25 -37.11 39.05 Favored 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 122.91 2.407 . . . . 0.0 112.742 -178.401 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.425 ' O ' HG21 ' A' ' 9' ' ' VAL . 5.3 mp0 -64.62 -36.32 83.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.857 179.333 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.451 ' HB3' HG22 ' A' ' 3' ' ' VAL . 25.8 tp10 -68.37 -36.03 78.6 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 175.765 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.93 -41.38 91.43 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.338 179.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . 0.425 HG21 ' O ' ' A' ' 6' ' ' GLU . 19.4 m -70.55 -23.24 24.19 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 CA-C-O 120.895 0.378 . . . . 0.0 110.29 178.717 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.475 ' O ' ' HD2' ' A' ' 17' ' ' LYS . 67.4 mmtt -67.13 -39.34 86.61 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-O 121.077 0.465 . . . . 0.0 109.847 171.68 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . 0.477 ' CH2' HG21 ' A' ' 3' ' ' VAL . 47.1 m0 -62.74 -27.09 69.04 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 175.075 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -72.42 -31.77 62.96 Favored Glycine 0 CA--C 1.52 0.358 0 CA-C-N 115.392 -0.822 . . . . 0.0 112.911 178.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.443 ' HG2' ' O ' ' A' ' 10' ' ' LYS . 11.5 pt-20 -82.56 -23.11 34.65 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 117.147 0.474 . . . . 0.0 111.162 -178.941 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.511 ' HB2' ' HG2' ' A' ' 17' ' ' LYS . 49.8 m -152.22 107.68 3.3 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -179.619 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' PHE . . . . . 0.465 ' CD1' HD22 ' A' ' 18' ' ' LEU . 40.2 t80 -53.65 -27.42 27.3 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.55 175.49 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -59.2 -54.11 50.61 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.328 177.43 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.511 ' HG2' ' HB2' ' A' ' 14' ' ' SER . 17.7 ptpt -71.56 -20.08 62.07 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 120.937 -0.305 . . . . 0.0 110.599 -175.121 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.477 ' O ' ' HA3' ' A' ' 24' ' ' GLY . 48.9 tp -59.01 -48.95 79.75 Favored 'General case' 0 N--CA 1.463 0.183 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 169.656 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.465 HD21 ' CZ2' ' A' ' 44' ' ' TRP . 0.8 OUTLIER -77.44 -27.52 52.22 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.948 -179.539 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.468 ' HB3' ' HA ' ' A' ' 17' ' ' LYS . 9.7 t -74.61 -25.08 59.01 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.508 -178.125 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -92.15 126.79 37.38 Favored 'General case' 0 C--O 1.232 0.179 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 177.784 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 36.2 ttm180 -51.6 -39.71 58.49 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 120.739 0.304 . . . . 0.0 110.569 179.355 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -61.73 -40.55 95.47 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.051 179.212 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.477 ' HA3' ' O ' ' A' ' 18' ' ' LEU . . . -68.11 -48.94 50.43 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.855 -0.688 . . . . 0.0 111.517 -179.416 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 7.8 tt -58.23 -38.66 77.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.025 0.441 . . . . 0.0 110.07 174.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -61.22 -51.71 67.82 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.379 179.234 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -68.73 -32.95 73.1 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.916 179.468 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -73.73 -37.59 65.05 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.951 -176.284 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.439 ' O ' ' HB2' ' A' ' 33' ' ' LYS . 11.2 t -71.23 -44.39 65.43 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 121.027 -0.269 . . . . 0.0 110.58 -178.816 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 11.8 ptm180 -64.71 -32.73 74.53 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 120.847 0.356 . . . . 0.0 110.39 178.842 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 85.7 t80 -70.29 -55.73 8.48 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.205 177.338 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.432 HD23 ' HA ' ' A' ' 38' ' ' GLU . 25.5 tp -67.02 -16.5 64.4 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.996 -176.877 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.439 ' HB2' ' O ' ' A' ' 29' ' ' THR . 22.3 ttmm -69.6 -18.82 63.65 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.699 178.944 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 13.9 t -56.61 -26.32 55.35 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.038 0.447 . . . . 0.0 111.215 -179.145 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -124.59 8.12 8.28 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.39 179.376 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 53.37 41.22 32.14 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.583 176.761 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 50.5 m -107.49 20.51 18.8 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.937 179.551 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.432 ' HA ' HD23 ' A' ' 32' ' ' LEU . 6.6 pt-20 -69.3 -6.94 32.73 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.035 178.684 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -42.73 -38.4 2.07 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.049 171.113 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . 0.514 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 50.0 m-80 -64.75 -57.83 7.89 Favored 'General case' 0 C--O 1.245 0.831 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.568 -176.117 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.44 ' O ' HG13 ' A' ' 45' ' ' ILE . 9.8 tt -60.9 -41.05 87.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.13 -0.486 . . . . 0.0 109.822 -177.85 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.522 ' HA ' ' HB ' ' A' ' 45' ' ' ILE . 53.7 mt-10 -67.14 -30.14 70.05 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.859 178.213 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.514 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 81.4 t80 -54.49 -60.71 2.99 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.559 179.16 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' TRP . . . . . 0.621 ' HA ' ' SG ' ' A' ' 47' ' ' CYS . 26.4 p-90 -79.8 -14.51 58.64 Favored 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 119.357 -0.937 . . . . 0.0 111.614 -178.645 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ILE . . . . . 0.522 ' HB ' ' HA ' ' A' ' 42' ' ' GLU . 18.4 mt -62.99 -38.72 82.75 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 168.612 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.93 -36.27 82.91 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.872 174.226 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.621 ' SG ' ' HA ' ' A' ' 44' ' ' TRP . 64.3 m -61.51 -31.08 71.06 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.726 176.566 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.491 ' HG2' ' O ' ' A' ' 44' ' ' TRP . 9.2 mm-40 -73.82 -38.21 64.62 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 120.968 0.413 . . . . 0.0 109.899 176.398 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -57.74 -35.95 71.4 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.409 0.623 . . . . 0.0 109.9 174.446 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 51.0 t80 -72.46 -45.28 60.23 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 114.862 -1.063 . . . . 0.0 110.398 174.371 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.459 ' HB3' ' HA ' ' A' ' 48' ' ' GLU . 4.1 tmtm? -54.73 -38.27 66.92 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.635 -0.711 . . . . 0.0 112.502 -176.631 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 22.9 pttm -72.74 -21.19 61.06 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.043 0.449 . . . . 0.0 110.792 -176.318 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 22.7 m -81.46 75.79 8.41 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.187 -177.427 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.88 -5.99 42.03 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.943 -176.07 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -73.65 125.96 9.55 Favored Glycine 0 CA--C 1.521 0.414 0 C-N-CA 121.142 -0.552 . . . . 0.0 112.258 177.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . 0.442 ' O ' ' HD2' ' A' ' 60' ' ' HIS . 89.0 Cg_exo -48.0 -46.53 21.75 Favored 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 123.037 2.491 . . . . 0.0 112.84 -177.201 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -63.12 -42.3 99.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.625 -179.325 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -64.08 -36.7 84.88 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.578 -177.515 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 30.6 mm -51.96 -55.92 7.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.298 179.111 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.442 ' HD2' ' O ' ' A' ' 56' ' ' PRO . 61.2 m-70 -62.89 -38.76 92.18 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.947 -175.701 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 88.6 mt -69.16 -55.16 11.49 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.012 -178.069 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.454 ' HA ' ' HE2' ' A' ' 62' ' ' LYS . 7.4 mmpt? -59.83 -40.09 87.31 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.013 -178.201 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.12 -46.86 84.85 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.771 178.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 4.2 tppp? -66.04 -32.2 73.54 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.79 -179.63 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.03 -59.16 5.49 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 120.945 0.403 . . . . 0.0 110.25 177.565 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 65.5 mt -59.52 -35.19 57.62 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.331 178.315 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 77.2 t80 -54.17 -63.22 1.22 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.944 -179.713 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -79.35 -9.6 59.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 0.0 112.185 -172.787 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 56.1 tptt -98.02 -33.34 11.22 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 111.627 0.232 . . . . 0.0 111.627 -179.743 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 69.9 m-85 -128.05 -43.86 1.48 Allowed 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -173.34 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 49.6 mm -67.82 -40.49 83.75 Favored 'Isoleucine or valine' 0 C--O 1.238 0.468 0 CA-C-O 120.912 0.387 . . . . 0.0 111.185 -173.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . 0.537 ' HB2' ' HB3' ' A' ' 75' ' ' ALA . 15.8 mm100 -60.59 141.53 56.55 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.541 178.119 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 92.4 m -67.13 -53.25 32.36 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.543 -179.477 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -88.95 27.9 1.27 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.631 -179.506 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.537 ' HB3' ' HB2' ' A' ' 72' ' ' GLN . . . -62.28 160.04 35.27 Favored Pre-proline 0 CA--C 1.531 0.247 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.0 178.358 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -72.19 48.05 1.14 Allowed 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 123.136 2.557 . . . . 0.0 112.48 176.249 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -178.92 -59.0 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 178.07 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 69.86 126.48 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.756 -177.439 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 57.8 t -121.04 138.2 52.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.422 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.935 177.189 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 37.1 m-80 -75.08 86.05 2.35 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.509 0.671 . . . . 0.0 111.075 179.567 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 15.1 tp -125.58 151.92 45.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.102 -0.953 . . . . 0.0 109.974 178.395 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -57.49 135.37 56.61 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.397 179.293 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 81.6 m-85 -67.68 -42.65 81.75 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.06 -175.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 72.7 t60 -58.62 -31.89 68.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.965 0.412 . . . . 0.0 110.381 178.285 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 37.7 m -66.97 -46.54 74.32 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.741 178.346 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -69.68 -24.99 63.67 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.226 -179.419 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -59.24 -52.41 65.79 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.392 0.615 . . . . 0.0 109.892 174.504 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 91.6 t -59.52 -39.28 78.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.027 177.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 81.5 mt -63.41 -43.8 98.65 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.04 179.107 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 33.7 p -65.09 -23.68 67.23 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-O 120.828 0.347 . . . . 0.0 111.097 -178.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 39.2 m-80 -86.92 -21.76 26.09 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.897 176.065 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 28.2 t -99.35 -9.49 23.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.29 -177.345 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.4 tp -58.16 -26.29 29.03 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 CA-C-O 120.783 0.325 . . . . 0.0 111.665 -175.771 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 6.0 t -62.95 -44.59 95.66 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.103 -179.835 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -148.62 79.9 8.52 Favored Pre-proline 0 N--CA 1.464 0.225 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 179.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -84.73 155.11 11.76 Favored 'Trans proline' 0 N--CA 1.46 -0.454 0 C-N-CA 122.579 2.186 . . . . 0.0 112.104 179.164 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 25.2 p -89.63 169.67 11.12 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.387 175.675 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 9.0 mp -53.28 -27.79 24.57 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 122.818 0.447 . . . . 0.0 112.043 -175.396 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' HIS . . . . . 0.458 ' HD2' ' HB2' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -131.02 44.01 3.02 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.101 0.477 . . . . 0.0 110.118 177.224 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 34.7 t -57.49 -34.47 69.08 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.471 176.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 85.7 m-85 -81.88 14.68 2.59 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.367 -178.322 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -57.83 -44.2 86.32 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 120.831 0.348 . . . . 0.0 110.537 -178.725 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.34 -43.05 96.82 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 121.06 0.457 . . . . 0.0 110.751 177.511 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.68 -37.85 88.92 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.168 178.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' GLN . . . . . 0.579 HE21 ' HB2' ' A' ' 44' ' ' TRP . 34.3 tt0 -63.7 -45.05 91.74 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.137 178.232 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 36.5 m -57.74 -47.19 83.17 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.358 177.611 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 23.0 mmt180 -52.71 -62.66 1.51 Allowed 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.947 178.297 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' VAL . . . . . 0.443 HG12 ' HB3' ' A' ' 40' ' ' ASN . 80.8 t -60.23 -42.6 90.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.449 -176.118 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 49.9 t80 -56.44 -51.88 66.74 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.095 -178.246 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 5.2 pp0? -73.45 -23.9 60.16 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 116.785 -0.189 . . . . 0.0 111.427 -176.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 61.7 mt -67.61 -49.14 64.5 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.82 0.343 . . . . 0.0 110.235 175.637 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 49.7 mtm -64.34 -36.48 84.27 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 116.158 -0.474 . . . . 0.0 109.886 178.061 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . 0.587 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 44.7 tt0 -55.74 -65.69 0.55 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.631 179.64 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -62.0 -15.64 45.64 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 113.034 0.753 . . . . 0.0 113.034 -171.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -121.84 -61.95 1.45 Allowed 'General case' 0 N--CA 1.466 0.33 0 O-C-N 121.979 -0.45 . . . . 0.0 112.059 -176.002 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 2.6 m -68.74 -39.09 80.5 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.886 -177.018 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' TYR . . . . . 0.587 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 36.1 t80 -78.24 -37.81 44.42 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.986 -173.831 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 21.1 p -61.05 -48.94 79.4 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.219 0.533 . . . . 0.0 110.111 176.342 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 65.5 mtm180 -64.62 -34.33 78.02 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.39 176.236 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -61.27 -37.6 83.75 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.623 177.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 95.4 mt -63.66 -44.93 92.34 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.203 0.525 . . . . 0.0 110.606 177.546 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 23.0 tptp -92.13 5.02 51.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.696 -174.016 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 85.3 p -69.09 141.19 54.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.786 0.327 . . . . 0.0 110.918 178.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -56.07 -32.7 64.34 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.042 177.202 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -65.76 -36.86 78.58 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.237 179.592 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -74.44 -38.0 63.12 Favored 'General case' 0 C--O 1.233 0.192 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 177.059 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 95.8 mt -61.75 -28.43 69.43 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.972 175.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -69.4 -41.7 76.08 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.086 173.585 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 98.1 mt -63.41 -25.68 68.39 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.569 178.302 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' MET . . . . . 0.635 ' HA ' ' HE3' ' A' ' 130' ' ' MET . 28.8 mmt . . . . . 0 C--N 1.33 -0.24 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.247 175.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 49.4 m . . . . . 0 N--CA 1.476 0.865 0 N-CA-C 110.266 -0.272 . . . . 0.0 110.266 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 56.5 ttp -64.69 106.0 1.1 Allowed 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -174.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 2.9 p -137.21 139.49 43.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.275 175.292 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.1 m -96.19 149.89 36.49 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.046 178.05 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -51.0 -35.54 50.65 Favored 'Trans proline' 0 C--N 1.352 0.715 0 C-N-CA 122.88 2.387 . . . . 0.0 112.364 -179.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.489 ' O ' HG22 ' A' ' 9' ' ' VAL . 34.4 tt0 -59.78 -52.0 67.35 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.06 0.457 . . . . 0.0 110.408 176.678 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 32.8 tp10 -56.49 -39.22 72.91 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.641 177.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.96 -46.02 86.5 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 115.758 -0.656 . . . . 0.0 111.731 -179.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.489 HG22 ' O ' ' A' ' 6' ' ' GLU . 24.7 m -67.16 -28.32 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 CA-C-O 120.931 0.396 . . . . 0.0 110.229 -179.862 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -70.7 -32.05 69.13 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.227 175.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 53.2 m0 -66.4 -21.88 66.23 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 173.747 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -83.17 2.15 87.48 Favored Glycine 0 C--N 1.335 0.495 0 CA-C-N 115.707 -0.678 . . . . 0.0 112.915 -179.45 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -125.51 -41.33 2.02 Favored 'General case' 0 C--O 1.234 0.274 0 O-C-N 122.803 -0.234 . . . . 0.0 110.532 176.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 14.0 m -108.74 101.92 11.01 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 120.842 0.353 . . . . 0.0 110.983 -178.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -61.95 -39.7 93.02 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.459 -178.612 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -64.7 -31.63 72.94 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.525 178.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 62.5 tttp -70.5 -35.07 73.01 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 179.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.4 tp -62.15 -48.0 82.03 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.025 173.568 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.4 ' O ' ' HB2' ' A' ' 25' ' ' LEU . 60.2 tp -65.93 -49.07 69.26 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.624 -177.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 44.1 m -67.33 -29.43 69.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.788 -173.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -76.67 119.78 20.95 Favored 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 179.539 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -51.61 -39.19 57.54 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 121.088 0.471 . . . . 0.0 110.632 -176.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -66.78 -38.33 86.33 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.12 -179.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -71.95 -50.17 19.44 Favored Glycine 0 C--N 1.333 0.382 0 CA-C-N 115.505 -0.77 . . . . 0.0 111.955 -178.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.4 ' HB2' ' O ' ' A' ' 19' ' ' LEU . 7.9 tt -52.0 -43.16 63.52 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 122.787 0.435 . . . . 0.0 110.112 175.501 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.497 ' O ' ' HG3' ' A' ' 30' ' ' ARG . 13.6 tp10 -58.12 -56.07 26.79 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.466 178.179 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -60.76 -40.78 93.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.333 -177.281 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 62.8 t80 -69.71 -43.6 72.05 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.785 -175.004 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.428 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 11.6 t -67.9 -41.21 83.04 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 121.075 -0.25 . . . . 0.0 110.732 -178.466 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.497 ' HG3' ' O ' ' A' ' 26' ' ' GLU . 58.7 mtp180 -62.16 -43.22 99.33 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.974 0.416 . . . . 0.0 110.235 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.556 ' O ' HG23 ' A' ' 34' ' ' THR . 87.0 t80 -64.45 -47.13 80.22 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.978 175.816 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.435 HD23 ' HA ' ' A' ' 38' ' ' GLU . 12.2 tp -64.95 -21.83 66.9 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.86 -175.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.428 ' HG3' ' O ' ' A' ' 29' ' ' THR . 38.8 mttp -68.06 -29.98 69.08 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.713 178.591 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.556 HG23 ' O ' ' A' ' 31' ' ' PHE . 3.6 t -65.7 -21.93 66.58 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 120.871 0.367 . . . . 0.0 110.647 -177.208 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -118.56 7.44 11.8 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.819 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 56.2 t80 58.24 19.17 5.97 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.864 175.051 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 42.2 m -79.27 0.7 27.65 Favored 'General case' 0 C--N 1.327 -0.384 0 O-C-N 121.985 -0.447 . . . . 0.0 110.636 -178.216 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.45 ' HA ' HG22 ' A' ' 41' ' ' ILE . 7.5 pt-20 -59.26 -22.88 61.8 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.61 176.661 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -53.21 -45.98 68.85 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.665 176.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.507 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 91.7 m-20 -64.4 -52.19 59.42 Favored 'General case' 0 C--O 1.241 0.654 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.633 -177.255 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.455 ' O ' HG13 ' A' ' 45' ' ' ILE . 13.0 tt -61.46 -44.7 99.01 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.155 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.369 -177.259 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.498 ' HA ' ' HB ' ' A' ' 45' ' ' ILE . 40.9 mt-10 -73.26 -21.19 60.66 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.101 -179.779 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.507 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 37.1 t80 -58.16 -60.5 3.66 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 120.614 0.245 . . . . 0.0 110.34 175.27 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.557 ' HB2' ' HG2' ' A' ' 105' ' ' GLN . 47.1 p-90 -75.77 -18.78 59.41 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 119.893 -0.723 . . . . 0.0 111.35 -177.667 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.498 ' HB ' ' HA ' ' A' ' 42' ' ' GLU . 41.4 mt -63.62 -41.51 92.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 169.656 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.07 -31.25 72.02 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.216 175.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.496 ' SG ' ' HA ' ' A' ' 44' ' ' TRP . 74.5 m -67.61 -32.73 73.66 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.433 176.812 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 55.0 mm-40 -71.52 -37.02 71.24 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 116.595 -0.275 . . . . 0.0 110.419 175.051 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -65.57 -36.74 84.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.422 0.629 . . . . 0.0 109.406 176.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.405 ' CZ ' HG21 ' A' ' 59' ' ' ILE . 50.4 t80 -62.67 -47.05 85.36 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 114.977 -1.01 . . . . 0.0 109.951 172.612 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.97 -22.72 65.88 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 115.386 -0.824 . . . . 0.0 111.163 178.405 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.437 ' HE2' ' HB3' ' A' ' 52' ' ' LYS . 32.4 ttpt -76.8 -18.45 58.41 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.916 -0.583 . . . . 0.0 111.032 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 22.6 t -66.39 159.51 26.78 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 121.11 0.481 . . . . 0.0 111.159 -176.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.3 15.95 2.59 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.743 179.089 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -104.13 105.77 2.66 Favored Glycine 0 CA--C 1.518 0.271 0 N-CA-C 111.096 -0.802 . . . . 0.0 111.096 177.022 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -48.58 -50.49 12.27 Favored 'Trans proline' 0 C--N 1.35 0.613 0 C-N-CA 123.017 2.478 . . . . 0.0 112.863 -176.004 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 3.6 pp0? -65.89 -34.52 78.32 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.77 0.319 . . . . 0.0 110.888 177.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -68.07 -30.22 69.36 Favored 'General case' 0 N--CA 1.461 0.112 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.934 -179.124 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.405 HG21 ' CZ ' ' A' ' 50' ' ' PHE . 40.8 mm -56.88 -43.56 80.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.199 176.424 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 21.6 m-70 -69.65 -42.05 74.74 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.568 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 85.9 mt -64.01 -44.55 92.26 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.802 -179.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -66.79 -46.81 74.1 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.552 179.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.62 -40.24 91.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.223 -178.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 38.2 mmtm -65.72 -37.51 86.61 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.739 178.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.8 -53.95 46.41 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.089 0.471 . . . . 0.0 109.963 176.117 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.411 ' HA ' ' HD1' ' A' ' 70' ' ' PHE . 69.9 mt -59.6 -35.05 57.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.366 178.778 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.464 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 40.1 t80 -57.92 -68.13 0.27 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.215 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -67.56 -33.74 75.65 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.446 -173.375 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.447 ' HA ' ' HD2' ' A' ' 76' ' ' PRO . 88.1 tttt -86.58 -29.13 22.85 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.958 -0.565 . . . . 0.0 112.098 -172.544 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . 0.411 ' HD1' ' HA ' ' A' ' 66' ' ' ILE . 96.1 m-85 -125.03 -53.4 1.64 Allowed 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -174.556 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.464 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 42.4 mm -64.28 -34.39 68.79 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -169.28 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.434 ' HA ' ' OE1' ' A' ' 72' ' ' GLN . 14.1 mm-40 -58.27 155.86 10.86 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.469 0.652 . . . . 0.0 111.968 -177.513 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.8 t -74.59 -28.65 61.01 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.009 179.233 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -87.51 -82.66 0.22 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.209 175.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . 57.19 158.66 0.08 OUTLIER Pre-proline 0 CA--C 1.542 0.636 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 174.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.447 ' HD2' ' HA ' ' A' ' 69' ' ' LYS . 64.2 Cg_endo -75.25 -16.34 19.72 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.31 2.006 . . . . 0.0 111.602 170.871 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -105.61 -51.81 2.93 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.418 177.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 64.51 93.59 0.06 Allowed 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.299 -175.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.401 ' C ' ' H ' ' A' ' 81' ' ' LEU . 65.5 t -86.29 141.92 13.79 Favored 'Isoleucine or valine' 0 C--O 1.237 0.443 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.759 -178.521 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 36.4 m-80 -78.14 23.41 0.28 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.42 -176.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.401 ' H ' ' C ' ' A' ' 79' ' ' VAL . 18.0 tp -65.57 142.81 57.97 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.964 177.825 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -48.57 140.11 8.52 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.64 -0.709 . . . . 0.0 112.067 -179.087 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 84.3 t80 -61.1 -52.89 62.98 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.387 -176.171 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 57.3 t60 -59.43 -38.59 81.08 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.869 0.366 . . . . 0.0 110.641 -177.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.436 ' O ' HG13 ' A' ' 89' ' ' ILE . 41.0 m -66.25 -51.62 55.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.76 -179.372 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.536 ' O ' HG21 ' A' ' 90' ' ' THR . 18.1 ptmt -67.29 -25.61 66.13 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.594 -177.64 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -64.08 -52.45 59.25 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-O 121.479 0.657 . . . . 0.0 109.405 175.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 99.0 t -58.95 -37.01 64.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.306 177.24 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.436 HG13 ' O ' ' A' ' 85' ' ' THR . 72.8 mt -66.98 -45.04 88.05 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.222 179.365 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.536 HG21 ' O ' ' A' ' 86' ' ' LYS . 48.4 p -57.34 -26.12 60.47 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 120.987 0.423 . . . . 0.0 110.757 -178.712 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -87.8 -41.42 13.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.148 175.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 22.5 t -79.51 -0.92 35.3 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.615 -174.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.9 tp -74.57 -4.53 5.78 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 CA-C-O 120.848 0.356 . . . . 0.0 111.552 -177.294 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 4.5 t -65.11 -47.18 78.08 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 116.686 -0.234 . . . . 0.0 110.881 179.048 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -132.23 81.35 61.41 Favored Pre-proline 0 N--CA 1.466 0.369 0 CA-C-O 121.161 0.505 . . . . 0.0 110.341 175.676 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_endo -71.43 139.62 35.01 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.746 2.298 . . . . 0.0 112.734 -176.601 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' THR . . . . . 0.411 ' H ' ' HB3' ' A' ' 100' ' ' SER . 35.4 p -87.18 172.93 9.55 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.419 173.509 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 41.7 tp -57.79 -36.61 72.42 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 121.189 0.519 . . . . 0.0 110.778 -179.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . 0.496 ' HB3' ' HB3' ' A' ' 102' ' ' ASP . 33.8 m-70 -113.28 38.87 2.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.12 177.174 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' SER . . . . . 0.411 ' HB3' ' H ' ' A' ' 97' ' ' THR . 9.2 p -55.39 -38.78 69.34 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.053 0.454 . . . . 0.0 111.422 -179.833 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 -93.95 21.84 6.29 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.409 -177.342 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . 0.496 ' HB3' ' HB3' ' A' ' 99' ' ' HIS . 7.3 p-10 -63.99 -35.29 80.2 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 120.976 0.417 . . . . 0.0 110.192 -179.451 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.48 ' O ' ' HG2' ' A' ' 107' ' ' ARG . . . -63.42 -48.47 77.66 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.887 174.795 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -58.33 -43.1 88.07 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.505 179.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.557 ' HG2' ' HB2' ' A' ' 44' ' ' TRP . 0.9 OUTLIER -57.06 -53.16 61.27 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.778 178.397 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 47.4 m -58.47 -48.17 81.64 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.165 -178.793 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . 0.48 ' HG2' ' O ' ' A' ' 103' ' ' ALA . 29.9 mmt180 -56.64 -65.05 0.68 Allowed 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.958 0.409 . . . . 0.0 110.886 -178.578 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.415 ' O ' ' HG3' ' A' ' 112' ' ' MET . 63.5 t -58.46 -38.57 70.92 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.4 -174.184 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 86.8 t80 -56.52 -56.6 19.22 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.77 179.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 1.1 pp0? -75.29 -12.89 60.37 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.629 -0.259 . . . . 0.0 111.237 -177.375 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.4 ' HG ' ' O ' ' A' ' 107' ' ' ARG . 53.4 mt -72.8 -45.56 57.88 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 173.266 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' MET . . . . . 0.415 ' HG3' ' O ' ' A' ' 108' ' ' VAL . 33.6 mtm -61.96 -34.81 76.81 Favored 'General case' 0 CA--C 1.52 -0.191 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 178.428 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . 0.556 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 3.9 tm-20 -56.81 -68.76 0.19 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.178 177.544 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -63.75 -19.43 64.95 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.866 -0.607 . . . . 0.0 112.305 -174.127 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -101.14 -71.33 0.71 Allowed 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 120.991 0.424 . . . . 0.0 111.523 -179.049 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 7.4 m -79.4 -33.54 42.64 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.068 -0.515 . . . . 0.0 112.136 -171.335 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . 0.556 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 41.4 t80 -75.24 -30.9 60.65 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.662 0.268 . . . . 0.0 110.773 -173.235 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 32.8 p -64.16 -56.21 16.38 Favored 'General case' 0 C--O 1.24 0.598 0 CA-C-O 120.991 0.424 . . . . 0.0 110.642 177.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 9.4 ptp85 -60.81 -32.48 71.84 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.021 177.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -60.77 -40.29 91.98 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.538 177.562 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 92.5 mt -71.62 -26.92 62.77 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.746 -178.318 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 16.4 tppt? -106.75 7.05 30.18 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 120.966 0.413 . . . . 0.0 111.342 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 86.9 p -74.8 156.61 36.33 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 110.249 -0.278 . . . . 0.0 110.249 178.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -58.74 -24.67 62.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.164 175.064 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 50.8 mm -61.92 -56.53 17.12 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.576 178.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 66.3 t80 -72.34 -37.75 68.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.548 -177.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 80.8 mt -63.81 -30.16 71.28 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.299 177.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -66.65 -38.73 87.48 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.091 174.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 98.8 mt -66.03 -28.59 68.98 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.301 176.069 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' MET . . . . . 0.572 ' HE2' ' HA ' ' A' ' 130' ' ' MET . 26.6 mmt -79.82 -38.02 33.86 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.732 179.187 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 57.59 26.19 12.53 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.042 -177.069 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . -73.34 -93.05 0.11 Allowed Glycine 0 N--CA 1.448 -0.53 0 CA-C-N 115.712 -0.677 . . . . 0.0 112.393 -179.21 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 23.9 ptt180 -157.85 133.6 5.94 Favored Pre-proline 0 CA--C 1.531 0.249 0 CA-C-O 120.45 0.167 . . . . 0.0 111.196 -176.676 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo . . . . . 0 C--N 1.347 0.464 0 C-N-CA 122.883 2.389 . . . . 0.0 111.282 171.393 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 16.9 t . . . . . 0 N--CA 1.48 1.06 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 24.7 ptm -119.58 119.6 34.25 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.845 0.355 . . . . 0.0 110.468 178.362 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 13.3 p -83.89 155.98 3.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.35 178.183 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.7 m -66.11 135.62 95.16 Favored Pre-proline 0 CA--C 1.535 0.387 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.261 175.391 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -49.01 -29.58 16.01 Favored 'Trans proline' 0 C--N 1.354 0.864 0 C-N-CA 123.038 2.492 . . . . 0.0 112.281 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -52.61 -59.96 3.83 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.748 177.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.51 ' HA ' ' HB3' ' A' ' 10' ' ' LYS . 25.5 tt0 -79.82 -22.67 42.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.823 -177.614 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -56.9 -46.49 81.9 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 120.87 0.367 . . . . 0.0 110.304 176.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 33.7 m -76.16 -29.04 19.01 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.382 177.119 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.51 ' HB3' ' HA ' ' A' ' 7' ' ' GLU . 16.2 tppt? -65.08 -27.51 68.82 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.808 176.606 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 43.6 m0 -65.96 -27.52 68.22 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 120.682 0.277 . . . . 0.0 110.615 175.477 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -61.6 -12.55 34.23 Favored Glycine 0 CA--C 1.52 0.371 0 CA-C-N 115.728 -0.669 . . . . 0.0 114.209 -173.047 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' A' ' 10' ' ' LYS . 12.0 pt-20 -104.36 -14.85 15.61 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 117.367 0.583 . . . . 0.0 111.901 -178.605 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.538 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 19.3 m -145.21 95.03 2.61 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-O 120.987 0.423 . . . . 0.0 111.901 -173.339 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.452 ' O ' ' HB3' ' A' ' 18' ' ' LEU . 15.9 t80 -54.86 -32.24 60.53 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.377 0.608 . . . . 0.0 109.884 175.122 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -57.15 -50.37 73.04 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.425 176.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.538 ' HG2' ' O ' ' A' ' 14' ' ' SER . 13.0 ptmm? -69.99 -22.86 63.09 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 120.81 -0.356 . . . . 0.0 110.081 -175.865 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.452 ' HB3' ' O ' ' A' ' 15' ' ' PHE . 62.8 tp -59.55 -54.7 43.47 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.917 174.921 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -68.44 -34.72 76.49 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.655 177.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.441 ' HB3' ' HA ' ' A' ' 17' ' ' LYS . 23.9 t -64.43 -25.09 67.86 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.508 179.376 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 16.2 t-80 -88.84 113.66 24.63 Favored 'General case' 0 C--O 1.223 -0.29 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 177.565 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 8.4 ptm180 -47.23 -45.27 23.38 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-O 120.782 0.325 . . . . 0.0 111.601 -176.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -67.59 -34.46 77.06 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.068 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -72.37 -41.67 51.67 Favored Glycine 0 C--N 1.331 0.282 0 N-CA-C 111.396 -0.682 . . . . 0.0 111.396 -179.194 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 7.3 tt -60.0 -41.85 93.0 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 174.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.459 ' O ' ' HG3' ' A' ' 30' ' ' ARG . 30.2 tt0 -60.3 -55.5 32.95 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.77 176.676 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -56.75 -43.85 81.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.332 -178.301 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 80.2 t80 -68.45 -43.33 77.3 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.06 -176.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.454 HG21 ' O ' ' A' ' 26' ' ' GLU . 12.5 t -67.04 -35.7 80.47 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 120.665 -0.414 . . . . 0.0 110.083 -179.439 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.459 ' HG3' ' O ' ' A' ' 26' ' ' GLU . 43.4 mtp180 -64.74 -45.46 86.38 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 121.085 0.469 . . . . 0.0 109.753 176.23 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 80.1 t80 -62.43 -42.04 99.17 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.565 177.316 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.407 ' HA ' ' HB3' ' A' ' 35' ' ' GLU . 16.2 tp -75.42 -22.09 57.66 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.501 -176.438 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.514 ' HE2' ' HG3' ' A' ' 38' ' ' GLU . 1.5 mptm? -71.68 -47.26 55.36 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.013 174.31 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 14.5 t -73.46 -18.3 61.14 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 120.854 0.359 . . . . 0.0 110.085 177.538 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.407 ' HB3' ' HA ' ' A' ' 32' ' ' LEU . 10.2 tp10 -75.11 -25.05 58.2 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.318 171.445 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 33.9 t80 68.39 33.57 4.09 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.128 177.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.1 m -136.43 30.46 2.92 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.553 -178.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.514 ' HG3' ' HE2' ' A' ' 33' ' ' LYS . 0.1 OUTLIER -70.52 -11.49 60.96 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.009 -0.542 . . . . 0.0 111.193 -177.91 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -45.25 -37.32 4.58 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.275 176.372 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.601 HD22 ' HB2' ' A' ' 80' ' ' ASN . 4.4 m-20 -69.36 -50.54 45.26 Favored 'General case' 0 C--O 1.242 0.662 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.896 -178.671 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.466 HG23 ' O ' ' A' ' 38' ' ' GLU . 11.2 tt -64.83 -42.92 96.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 C-N-CA 121.021 -0.272 . . . . 0.0 110.281 -175.215 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.413 ' HA ' ' HB ' ' A' ' 45' ' ' ILE . 51.8 mt-10 -69.22 -25.36 64.27 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.433 -0.348 . . . . 0.0 110.482 178.783 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.483 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 78.1 t80 -57.54 -60.9 2.96 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.726 178.38 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.725 ' HA ' ' SG ' ' A' ' 47' ' ' CYS . 43.1 p-90 -78.78 -17.01 56.44 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 119.779 -0.769 . . . . 0.0 111.82 -178.336 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.413 ' HB ' ' HA ' ' A' ' 42' ' ' GLU . 30.7 mt -63.85 -38.51 82.53 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 168.268 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.71 -34.69 67.3 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.1 178.474 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.725 ' SG ' ' HA ' ' A' ' 44' ' ' TRP . 18.2 p -72.25 -23.67 61.25 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-O 120.562 0.22 . . . . 0.0 110.502 -179.252 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -67.97 -52.46 35.72 Favored 'General case' 0 CA--C 1.521 -0.139 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 170.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -55.92 -27.72 53.55 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.795 -0.638 . . . . 0.0 110.311 175.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.531 ' HA ' ' HD2' ' A' ' 62' ' ' LYS . 49.9 t80 -69.62 -50.35 45.23 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.991 178.052 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 64.8 pttt -72.52 -21.14 61.23 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 121.252 0.548 . . . . 0.0 110.157 178.684 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -74.68 -38.32 62.43 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.959 -176.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.8 p -63.24 128.68 36.93 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.905 0.383 . . . . 0.0 110.319 176.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -102.35 -1.75 30.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.206 -174.694 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -88.38 115.1 4.34 Favored Glycine 0 CA--C 1.521 0.457 0 C-N-CA 121.109 -0.567 . . . . 0.0 111.848 177.677 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -53.69 -33.84 71.45 Favored 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 122.886 2.391 . . . . 0.0 112.374 -178.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 58.2 mt-30 -65.47 -49.26 69.74 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.598 178.355 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -59.2 -38.53 80.12 Favored 'General case' 0 N--CA 1.461 0.109 0 CA-C-N 115.0 -1.0 . . . . 0.0 110.534 179.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.424 ' O ' ' HE1' ' A' ' 50' ' ' PHE . 43.1 mm -54.38 -53.83 26.93 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.039 178.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.457 ' HA ' ' HG2' ' A' ' 96' ' ' PRO . 17.6 m-70 -63.39 -46.95 84.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.317 -176.325 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 88.8 mt -67.52 -44.05 79.33 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.114 -176.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.531 ' HD2' ' HA ' ' A' ' 50' ' ' PHE . 40.1 ttmt -64.17 -41.01 97.3 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.543 -178.819 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.26 -41.1 92.54 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.416 178.122 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 65.5 tttm -65.88 -38.06 87.79 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.128 178.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.18 -52.14 64.98 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.385 176.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 75.4 mt -59.34 -35.99 61.38 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 CA-C-O 121.257 0.551 . . . . 0.0 110.014 178.136 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 90.2 t80 -58.43 -60.95 2.99 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.58 178.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -70.19 -18.21 63.18 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.886 -174.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 85.4 tttt -97.24 -28.76 13.93 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 111.887 0.328 . . . . 0.0 111.887 -174.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 70.9 m-85 -130.83 -46.45 1.04 Allowed 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 -173.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 48.0 mm -74.51 -34.2 34.89 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 CA-C-O 121.085 0.469 . . . . 0.0 111.392 -173.296 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.547 ' NE2' ' HB3' ' A' ' 74' ' ' ASP . 0.0 OUTLIER -61.39 137.47 58.24 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.328 -174.386 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 22.9 m -66.01 -24.22 66.72 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 121.387 0.613 . . . . 0.0 109.67 174.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.547 ' HB3' ' NE2' ' A' ' 72' ' ' GLN . 20.8 t70 -106.05 86.26 2.34 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 169.763 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -137.95 152.49 72.25 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.122 -179.517 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_exo -46.8 -48.81 13.4 Favored 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 123.124 2.55 . . . . 0.0 112.857 -178.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.429 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 94.0 mttt -116.32 -37.0 3.86 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.219 178.755 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.429 ' HB2' ' O ' ' A' ' 77' ' ' LYS . 44.0 mt-10 66.49 -177.47 0.2 Allowed 'General case' 0 C--O 1.234 0.279 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 -164.024 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.421 HG22 ' HD1' ' A' ' 43' ' ' PHE . 69.4 t -144.32 141.17 24.39 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 N-CA-C 110.339 -0.245 . . . . 0.0 110.339 177.463 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.601 ' HB2' HD22 ' A' ' 40' ' ' ASN . 34.7 m-80 -64.66 80.91 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.049 176.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 36.6 tp -127.5 143.73 51.15 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.432 -0.803 . . . . 0.0 109.741 179.011 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -50.38 132.2 24.62 Favored 'General case' 0 N--CA 1.466 0.371 0 O-C-N 123.427 0.454 . . . . 0.0 111.193 177.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -62.55 -38.2 89.13 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.911 -177.433 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . 0.459 ' O ' HG22 ' A' ' 88' ' ' VAL . 84.7 t60 -65.41 -36.94 85.47 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 179.005 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 48.3 m -66.38 -41.39 89.46 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.127 175.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -60.95 -41.37 96.18 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 175.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -57.66 -44.1 85.46 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.656 178.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.459 HG22 ' O ' ' A' ' 84' ' ' HIS . 99.4 t -56.93 -44.74 82.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.114 176.203 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 71.8 mt -70.23 -38.19 73.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.321 -177.224 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 41.7 p -65.05 -26.67 68.35 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 120.682 0.277 . . . . 0.0 111.063 -177.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 47.8 m-80 -86.31 -46.05 10.67 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.897 175.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 21.8 m -82.01 -3.61 54.88 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 -173.72 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 7.9 tp -56.38 -23.07 15.82 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 CA-C-O 120.975 0.417 . . . . 0.0 111.342 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 11.6 t -64.1 -33.64 76.22 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.417 -179.081 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 17.2 mm-40 -140.5 76.64 24.72 Favored Pre-proline 0 N--CA 1.466 0.34 0 CA-C-O 120.748 0.309 . . . . 0.0 110.251 -178.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . 0.457 ' HG2' ' HA ' ' A' ' 60' ' ' HIS . 72.0 Cg_endo -76.97 138.26 18.26 Favored 'Trans proline' 0 CA--C 1.531 0.371 0 C-N-CA 122.538 2.159 . . . . 0.0 112.085 179.776 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 5.8 m -105.82 162.72 13.3 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.422 -179.091 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -15.75 -57.87 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 125.037 1.335 . . . . 0.0 114.006 -177.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 58.6 t60 -146.23 35.83 1.0 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.874 -1.057 . . . . 0.0 109.593 -163.25 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 25.0 t -61.0 -10.99 6.68 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 114.973 -1.012 . . . . 0.0 112.071 -175.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 81.6 m-85 -87.34 14.64 7.59 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.805 -0.179 . . . . 0.0 111.221 178.289 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -59.01 -44.53 91.71 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 120.823 0.344 . . . . 0.0 110.811 -179.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.91 -42.07 97.33 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 121.221 0.534 . . . . 0.0 110.379 177.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.54 -39.34 91.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.631 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -60.47 -44.23 96.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.216 178.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 36.6 t -58.93 -52.12 67.1 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.326 178.191 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . 0.438 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 19.4 mmt180 -54.54 -61.37 2.35 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.159 -179.573 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.433 HG23 ' CD2' ' A' ' 43' ' ' PHE . 59.2 t -57.94 -46.43 87.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.569 -0.742 . . . . 0.0 112.052 -173.785 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 68.3 t80 -57.71 -52.72 64.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.983 -178.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.438 ' HG3' ' O ' ' A' ' 107' ' ' ARG . 0.0 OUTLIER -71.93 -31.76 66.67 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.929 0.395 . . . . 0.0 110.887 -176.381 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 31.9 tp -68.94 -38.5 79.53 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.952 -175.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' MET . . . . . 0.433 ' HB3' HD21 ' A' ' 40' ' ' ASN . 24.4 ptt? -82.4 -22.25 35.46 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 176.709 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . 0.678 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 37.2 tt0 -61.82 -59.61 4.88 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.141 178.27 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -49.14 -35.42 16.52 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.195 -176.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -104.92 -65.93 1.01 Allowed 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 -175.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 33.3 t -63.92 -36.57 84.38 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 111.698 0.258 . . . . 0.0 111.698 -173.139 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . 0.678 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 15.5 t80 -70.0 -40.23 75.41 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 120.453 0.168 . . . . 0.0 110.925 -177.867 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 28.8 p -65.63 -44.26 87.01 Favored 'General case' 0 C--O 1.241 0.648 0 CA-C-O 121.186 0.517 . . . . 0.0 109.966 176.27 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 75.1 mtp85 -57.24 -40.15 77.01 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.077 174.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -61.43 -40.76 95.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.095 176.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 89.8 mt -68.88 -8.96 48.88 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.202 179.286 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . 0.671 ' HB2' ' HZ2' ' A' ' 122' ' ' LYS . 0.1 OUTLIER -130.65 20.32 5.11 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 120.917 0.389 . . . . 0.0 111.44 173.608 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 89.1 p -65.92 161.93 20.21 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.949 176.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 15.5 p-10 -62.76 -43.66 98.21 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.354 -179.49 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 7.7 tp -62.61 -39.22 83.81 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.607 178.338 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' TYR . . . . . 0.431 ' O ' ' HG2' ' A' ' 130' ' ' MET . 58.0 t80 -66.8 -40.43 88.08 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 110.131 -0.322 . . . . 0.0 110.131 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 83.3 mt -61.74 -37.18 83.27 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.311 177.151 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -62.66 -43.17 99.5 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.188 175.153 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 95.1 mt -63.73 -30.0 71.15 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.606 176.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' MET . . . . . 0.672 ' HA ' ' HE1' ' A' ' 130' ' ' MET . 21.4 mmt -78.6 -27.8 45.62 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.619 177.74 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 44.45 22.84 0.06 Allowed 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.375 1.07 . . . . 0.0 112.989 179.454 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . -90.59 -24.87 27.09 Favored Glycine 0 C--N 1.331 0.251 0 N-CA-C 111.744 -0.542 . . . . 0.0 111.744 177.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 35.4 mmt180 -134.78 124.14 16.56 Favored Pre-proline 0 C--O 1.233 0.229 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 179.357 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo . . . . . 0 C--N 1.347 0.493 0 C-N-CA 122.551 2.167 . . . . 0.0 111.68 177.66 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 47.0 m . . . . . 0 N--CA 1.48 1.06 0 CA-C-O 120.584 0.23 . . . . 0.0 110.462 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 27.0 ptt? -159.1 169.92 23.16 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 120.745 0.307 . . . . 0.0 110.398 179.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.7 p -136.79 141.2 41.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.319 -179.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 34.8 t -88.91 148.11 40.51 Favored Pre-proline 0 C--N 1.327 -0.404 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 177.052 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_endo -48.62 -33.24 23.52 Favored 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 122.839 2.359 . . . . 0.0 111.869 179.286 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.521 ' O ' HG23 ' A' ' 9' ' ' VAL . 36.3 mt-10 -63.14 -54.16 42.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.143 178.035 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -63.3 -29.29 70.64 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.081 0.467 . . . . 0.0 109.959 178.03 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.22 -40.04 82.2 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.358 -179.348 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.521 HG23 ' O ' ' A' ' 6' ' ' GLU . 25.5 m -71.51 -21.92 21.75 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.269 0 C-N-CA 120.489 -0.484 . . . . 0.0 110.024 177.347 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.575 ' O ' ' HG2' ' A' ' 13' ' ' GLU . 5.6 mptp? -69.52 -16.37 63.42 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.852 173.186 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 42.8 m0 -80.3 -16.46 54.58 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.767 -0.456 . . . . 0.0 109.767 174.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -96.02 13.69 65.66 Favored Glycine 0 C--N 1.334 0.45 0 CA-C-N 115.708 -0.678 . . . . 0.0 112.858 -178.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.575 ' HG2' ' O ' ' A' ' 10' ' ' LYS . 11.5 pt-20 -111.78 -28.38 8.11 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 120.881 0.372 . . . . 0.0 110.457 175.708 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.8 m -152.6 117.51 5.12 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.322 -177.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 12.3 t80 -56.58 -36.84 69.8 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 172.223 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -52.19 -45.2 65.09 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 115.069 -0.969 . . . . 0.0 110.858 175.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.538 ' HD2' ' O ' ' A' ' 10' ' ' LYS . 40.4 ttmt -70.19 -36.29 74.52 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.301 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 67.3 tp -58.82 -43.41 90.64 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.078 176.259 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 51.5 tp -74.02 -34.71 64.22 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.574 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 33.6 t -63.81 -28.94 70.21 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.533 179.168 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -84.49 115.64 22.68 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 175.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.623 ' NH1' ' HB3' ' A' ' 22' ' ' ARG . 4.6 ttp-105 -56.49 -31.63 64.23 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 176.438 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -64.06 -46.71 83.16 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.397 176.38 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -62.93 -44.62 97.14 Favored Glycine 0 N--CA 1.45 -0.393 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.658 179.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 13.3 tp -52.36 -57.39 9.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.144 0.497 . . . . 0.0 110.475 174.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -58.74 -39.49 81.04 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-N 115.25 -0.886 . . . . 0.0 111.199 -175.434 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -71.4 -45.47 62.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.022 0.439 . . . . 0.0 110.976 179.017 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.47 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 74.2 t80 -72.98 -30.28 63.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.226 -174.876 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 13.6 t -76.02 -39.09 56.44 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 -177.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 37.2 ttt180 -59.72 -39.37 84.45 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.905 171.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.5 ' O ' HG22 ' A' ' 34' ' ' THR . 68.0 t80 -62.59 -53.45 54.39 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.822 -178.502 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.581 HD12 ' HA ' ' A' ' 38' ' ' GLU . 2.7 pp -73.91 -16.12 61.11 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 120.761 0.315 . . . . 0.0 111.406 -179.493 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.599 ' HD2' ' HB3' ' A' ' 38' ' ' GLU . 12.7 mptt -65.38 -50.23 66.32 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 120.962 0.41 . . . . 0.0 110.086 175.785 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.5 HG22 ' O ' ' A' ' 31' ' ' PHE . 13.8 t -68.66 -17.96 64.19 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.885 -174.262 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.537 ' HG2' ' HA ' ' A' ' 32' ' ' LEU . 12.5 pt-20 -97.56 8.76 44.05 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.736 0.303 . . . . 0.0 110.631 176.974 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 91.7 m-85 57.96 39.58 26.42 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.727 173.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 26.1 m -124.81 34.59 4.96 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.446 0.641 . . . . 0.0 109.3 177.179 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.599 ' HB3' ' HD2' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -83.43 -30.75 27.06 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.13 -0.941 . . . . 0.0 112.857 -170.079 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.635 ' HB3' ' HZ3' ' A' ' 77' ' ' LYS . 0.4 OUTLIER -57.71 -22.25 45.27 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 120.823 -0.351 . . . . 0.0 110.9 -177.058 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.523 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 58.1 m-80 -66.74 -50.46 62.69 Favored 'General case' 0 C--O 1.239 0.514 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.435 179.06 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.425 HG22 ' O ' ' A' ' 38' ' ' GLU . 13.9 tt -69.38 -40.67 80.31 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 C-N-CA 120.916 -0.314 . . . . 0.0 110.191 -178.751 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -61.69 -30.94 71.07 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.404 175.128 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.523 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 78.4 t80 -59.87 -66.58 0.49 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.405 179.603 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.615 ' HB2' ' HG3' ' A' ' 105' ' ' GLN . 47.2 p-90 -75.55 -18.5 59.75 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 120.176 -0.61 . . . . 0.0 112.516 -171.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 13.0 tt -73.39 -32.8 38.42 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 173.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.56 -27.69 65.34 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.927 -0.578 . . . . 0.0 109.904 174.346 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.479 ' SG ' ' HB2' ' A' ' 101' ' ' PHE . 41.4 t -68.83 -42.96 76.49 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.181 175.134 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 18.2 tp10 -65.1 -36.95 85.92 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 176.317 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.569 ' HA ' ' HE3' ' A' ' 52' ' ' LYS . 10.4 t70 -64.9 -38.26 90.38 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.378 173.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.494 ' HA ' ' HE2' ' A' ' 62' ' ' LYS . 8.5 t80 -56.15 -39.89 73.01 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.626 177.375 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.601 ' HB2' ' NZ ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -97.47 -5.28 36.37 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.826 0.676 . . . . 0.0 112.826 -173.656 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.569 ' HE3' ' HA ' ' A' ' 49' ' ' ASP . 18.4 ptpt -74.38 -28.4 61.09 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 175.267 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.2 p -74.24 150.5 40.26 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.982 174.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.64 4.7 5.54 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 111.678 0.251 . . . . 0.0 111.678 -177.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . 0.481 ' O ' HG12 ' A' ' 59' ' ' ILE . . . -75.12 120.44 6.2 Favored Glycine 0 CA--C 1.52 0.372 0 N-CA-C 111.169 -0.772 . . . . 0.0 111.169 175.652 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.446 ' O ' ' HD2' ' A' ' 60' ' ' HIS . 72.0 Cg_exo -49.0 -62.3 0.45 Allowed 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 122.878 2.386 . . . . 0.0 112.777 -175.498 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.83 -34.52 74.68 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 120.903 0.382 . . . . 0.0 110.519 -179.224 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.42 HE21 ' HD2' ' A' ' 62' ' ' LYS . 56.3 tp60 -60.65 -41.39 94.91 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.955 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.481 HG12 ' O ' ' A' ' 55' ' ' GLY . 44.2 mm -59.0 -41.44 83.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.683 179.096 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.446 ' HD2' ' O ' ' A' ' 56' ' ' PRO . 77.6 m-70 -64.95 -50.46 66.3 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.443 -177.237 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.45 HD13 ' N ' ' A' ' 62' ' ' LYS . 4.4 pp -70.54 -31.02 67.92 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.476 -175.309 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.494 ' HE2' ' HA ' ' A' ' 50' ' ' PHE . 60.5 mtpt -71.93 -41.73 67.49 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 120.777 0.323 . . . . 0.0 110.299 176.82 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.461 ' HB1' ' CE1' ' A' ' 50' ' ' PHE . . . -60.85 -44.69 96.67 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.691 178.427 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -65.51 -41.12 93.52 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.629 -177.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.99 -50.54 73.7 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-O 121.067 0.46 . . . . 0.0 110.567 177.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 70.1 mt -62.57 -38.19 80.85 Favored 'Isoleucine or valine' 0 C--O 1.231 0.127 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.327 178.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.547 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 49.1 t80 -55.74 -59.84 4.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.635 178.073 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -67.55 -24.61 65.55 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.427 -0.806 . . . . 0.0 112.603 -170.543 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -105.49 -25.41 12.34 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -176.051 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . 0.522 ' HB3' ' HD1' ' A' ' 43' ' ' PHE . 96.4 m-85 -125.04 -46.12 1.83 Allowed 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 112.678 0.622 . . . . 0.0 112.678 -171.725 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.547 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 48.4 mm -71.04 -37.93 69.62 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 CA-C-O 120.944 0.402 . . . . 0.0 110.647 -173.473 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 5.8 tp60 -72.64 129.41 38.19 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.227 179.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 27.2 m -60.17 -44.1 95.31 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.204 0.526 . . . . 0.0 110.103 178.077 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -74.82 79.33 2.1 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.152 175.254 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -132.3 156.82 79.64 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.727 -175.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -67.74 -30.32 34.34 Favored 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 122.704 2.269 . . . . 0.0 112.259 -179.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.635 ' HZ3' ' HB3' ' A' ' 39' ' ' GLU . 26.0 tptp -105.0 -39.4 6.26 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.981 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.421 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 51.5 mt-10 69.3 154.27 0.11 Allowed 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.297 -177.377 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.423 HG21 ' CD1' ' A' ' 43' ' ' PHE . 88.2 t -140.05 147.86 23.25 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.496 175.603 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -86.79 87.75 7.52 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.122 0.487 . . . . 0.0 109.97 178.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.476 HD13 HG22 ' A' ' 85' ' ' THR . 37.3 tp -134.86 145.67 48.51 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.79 -177.853 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -54.73 158.9 2.42 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-N 115.683 -0.69 . . . . 0.0 112.487 -177.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 55.7 m-85 -73.69 -57.25 4.11 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.79 -177.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . 0.436 ' O ' HG23 ' A' ' 88' ' ' VAL . 86.3 t60 -64.27 -31.03 72.08 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.996 -175.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.476 HG22 HD13 ' A' ' 81' ' ' LEU . 76.0 m -59.61 -51.76 68.43 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.67 179.205 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 9.7 ptpp? -71.24 -25.27 62.41 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.263 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -63.53 -41.64 98.47 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 121.231 0.539 . . . . 0.0 110.233 176.047 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.436 HG23 ' O ' ' A' ' 84' ' ' HIS . 81.3 t -64.06 -37.97 81.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 121.25 0.547 . . . . 0.0 109.66 174.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 75.6 mt -66.14 -40.3 86.71 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.258 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 40.2 p -61.78 -36.13 80.16 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 120.991 0.424 . . . . 0.0 110.376 179.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 28.7 m-80 -73.68 -29.23 62.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.903 175.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 50.5 m -94.8 -2.7 50.39 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -175.593 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 9.9 tp -61.35 -27.58 42.18 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.384 0 CA-C-O 120.874 0.369 . . . . 0.0 110.924 -177.269 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 15.0 t -78.97 -18.29 53.98 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.099 -178.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -140.58 75.66 26.01 Favored Pre-proline 0 N--CA 1.465 0.313 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.28 -179.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -75.08 143.07 28.36 Favored 'Trans proline' 0 C--O 1.236 0.377 0 C-N-CA 122.398 2.065 . . . . 0.0 111.688 178.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 3.4 m -130.09 168.43 16.78 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 -178.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.403 ' N ' HD21 ' A' ' 98' ' ' LEU . 3.2 mm? -64.71 3.73 0.49 Allowed 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 -170.119 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -157.14 19.72 0.3 Allowed 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 118.485 0.584 . . . . 0.0 111.854 174.301 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 30.0 m -55.21 -37.1 66.69 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 121.035 0.445 . . . . 0.0 111.789 -178.071 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.479 ' HB2' ' SG ' ' A' ' 47' ' ' CYS . 10.7 m-85 -89.79 16.89 7.27 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.519 -175.416 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -69.83 -32.96 71.67 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 120.85 0.357 . . . . 0.0 110.51 -177.606 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.9 -43.94 97.82 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 121.188 0.518 . . . . 0.0 109.943 176.148 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.13 -42.72 96.71 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.033 177.146 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.615 ' HG3' ' HB2' ' A' ' 44' ' ' TRP . 57.4 tt0 -57.34 -42.7 82.46 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.406 177.721 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 46.7 t -63.17 -53.22 56.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.996 -179.577 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . 0.432 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 20.0 mmm180 -57.21 -44.81 84.04 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.86 -174.342 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 57.7 t -77.26 -37.32 25.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.144 -175.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -60.57 -52.35 65.55 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.595 176.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.432 ' HG3' ' O ' ' A' ' 107' ' ' ARG . 0.0 OUTLIER -64.53 -31.31 72.47 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.064 0.459 . . . . 0.0 110.298 -178.745 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.403 ' HB2' ' O ' ' A' ' 107' ' ' ARG . 31.7 tp -65.74 -44.01 87.25 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.831 -176.579 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' MET . . . . . 0.495 ' HE2' ' HE1' ' A' ' 44' ' ' TRP . 28.1 mtm -72.49 -34.53 67.74 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 177.157 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . 0.587 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 7.1 tm-20 -57.56 -63.3 1.28 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.552 -178.328 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -54.8 -26.04 32.18 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.115 -0.493 . . . . 0.0 112.128 -174.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -103.66 -74.26 0.65 Allowed 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 120.803 0.335 . . . . 0.0 111.795 -176.459 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 15.6 t -64.84 -31.94 73.41 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.923 -170.442 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . 0.587 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 38.3 t80 -63.85 -40.88 97.6 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.617 0.246 . . . . 0.0 111.051 -176.743 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 63.5 p -61.72 -45.92 91.87 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-O 121.536 0.684 . . . . 0.0 109.965 179.177 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 52.8 mtp180 -59.58 -41.27 89.87 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.145 176.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 77.6 t80 -59.53 -34.2 72.34 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.46 179.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 94.5 mt -71.05 -26.01 62.9 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.161 178.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -115.89 21.43 13.82 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.393 177.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 97.9 p -75.7 152.21 37.53 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 120.645 0.26 . . . . 0.0 110.785 179.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -61.48 -29.14 69.78 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.353 0.597 . . . . 0.0 109.4 176.038 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.413 ' O ' ' HG ' ' A' ' 129' ' ' LEU . 45.2 mm -61.24 -52.93 55.69 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 115.087 -0.96 . . . . 0.0 110.21 174.343 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' TYR . . . . . 0.419 ' O ' ' HG2' ' A' ' 130' ' ' MET . 53.0 t80 -62.73 -38.74 91.68 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.587 -177.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 97.7 mt -60.77 -33.69 73.34 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.323 177.538 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -74.65 -34.3 62.7 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.373 177.192 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 125' ' ' ILE . 85.7 mt -71.26 -18.24 62.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.61 178.275 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' MET . . . . . 0.696 ' HE2' ' HA ' ' A' ' 130' ' ' MET . 21.6 mmt -75.67 -85.67 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.913 178.634 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 53.61 33.85 17.36 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.202 -176.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . -81.8 49.9 4.16 Favored Glycine 0 C--N 1.333 0.378 0 C-N-CA 121.306 -0.473 . . . . 0.0 112.152 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 20.0 tpt180 -75.26 112.03 16.63 Favored Pre-proline 0 CA--C 1.535 0.369 0 C-N-CA 123.067 0.547 . . . . 0.0 110.72 -178.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_endo . . . . . 0 C--N 1.346 0.412 0 C-N-CA 122.679 2.253 . . . . 0.0 111.769 177.244 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 50.5 p . . . . . 0 N--CA 1.476 0.868 0 CA-C-O 120.845 0.355 . . . . 0.0 110.754 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 4.5 ppp? -150.96 149.58 29.78 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 174.261 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . 0.44 HG21 ' CZ2' ' A' ' 11' ' ' TRP . 7.1 p -105.81 137.88 33.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 120.88 0.371 . . . . 0.0 111.502 -175.775 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.7 m -76.83 151.54 82.32 Favored Pre-proline 0 C--O 1.236 0.362 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.334 176.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -53.59 -34.89 75.1 Favored 'Trans proline' 0 C--N 1.351 0.67 0 C-N-CA 122.877 2.385 . . . . 0.0 112.652 -177.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 46.3 mm-40 -60.48 -52.87 63.35 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.966 -179.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.515 ' HA ' ' HE2' ' A' ' 10' ' ' LYS . 22.1 tp10 -65.27 -37.8 88.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.074 178.565 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.07 -53.56 57.0 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.232 -179.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.78 HG11 ' SD ' ' A' ' 130' ' ' MET . 22.9 m -66.94 -25.55 34.68 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-O 121.26 0.553 . . . . 0.0 110.572 -179.589 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.539 ' HG2' ' HE2' ' A' ' 17' ' ' LYS . 35.2 ttpt -76.14 -9.52 58.69 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.396 -175.618 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . 0.44 ' CZ2' HG21 ' A' ' 3' ' ' VAL . 45.9 m0 -66.98 -18.22 65.28 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.419 0.152 . . . . 0.0 111.1 177.773 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -76.26 60.87 3.13 Favored Glycine 0 C--N 1.333 0.374 0 CA-C-N 116.098 -0.501 . . . . 0.0 112.829 -177.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -150.74 -39.41 0.13 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.0 0.429 . . . . 0.0 110.34 176.322 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.405 ' HB3' ' OD1' ' A' ' 16' ' ' ASP . 69.3 m -142.1 125.08 16.17 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.678 -176.649 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.403 ' CZ ' ' SD ' ' A' ' 112' ' ' MET . 33.9 t80 -58.95 -40.21 84.01 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.028 178.489 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.405 ' OD1' ' HB3' ' A' ' 14' ' ' SER . 7.9 p-10 -64.66 -29.74 70.75 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.641 -0.708 . . . . 0.0 110.862 179.509 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.539 ' HE2' ' HG2' ' A' ' 10' ' ' LYS . 65.7 tttp -65.87 -38.22 88.21 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 121.163 0.506 . . . . 0.0 109.828 176.84 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.448 HD23 ' HB2' ' A' ' 28' ' ' PHE . 54.5 tp -59.91 -48.05 83.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.248 176.467 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -72.55 -25.56 61.4 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.178 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 30.2 t -60.02 -27.73 67.15 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 121.326 0.584 . . . . 0.0 109.572 176.119 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 71.5 m-70 -100.46 118.9 37.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.52 176.272 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 92.4 mtt180 -64.48 -27.34 68.92 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.87 0.367 . . . . 0.0 110.083 179.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -65.21 -41.28 94.63 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.861 172.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -67.7 -45.73 73.62 Favored Glycine 0 C--N 1.331 0.274 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.522 178.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 7.7 tt -54.74 -42.6 71.8 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.166 -0.517 . . . . 0.0 110.003 175.457 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.472 ' O ' ' HG2' ' A' ' 30' ' ' ARG . 19.2 tp10 -58.03 -53.77 54.46 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.267 178.849 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -61.14 -40.2 92.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.262 -178.122 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.448 ' HB2' HD23 ' A' ' 18' ' ' LEU . 80.9 t80 -68.47 -48.7 63.82 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.201 -176.804 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.8 t -61.61 -34.51 75.78 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-O 120.72 0.295 . . . . 0.0 110.339 -177.44 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.472 ' HG2' ' O ' ' A' ' 26' ' ' GLU . 26.5 mmt180 -59.38 -52.0 67.49 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.335 176.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -64.35 -42.23 96.33 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.669 179.054 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 13.7 tp -65.55 -27.62 68.57 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.582 -176.036 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.529 ' HG2' ' HB3' ' A' ' 38' ' ' GLU . 56.9 mttm -75.13 -43.93 49.88 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.082 177.104 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.1 t -71.41 -17.95 62.37 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 120.93 0.395 . . . . 0.0 110.177 177.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -92.09 13.47 18.8 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.632 174.552 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 41.7 p90 46.61 22.75 0.19 Allowed 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.353 1.061 . . . . 0.0 112.87 178.258 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 24.4 m -107.98 18.28 21.42 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.102 0.477 . . . . 0.0 110.153 179.049 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.529 ' HB3' ' HG2' ' A' ' 33' ' ' LYS . 11.6 pt-20 -54.23 -19.88 5.99 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.824 -178.324 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -49.84 -48.02 51.27 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.906 176.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 10.1 m120 -57.42 -61.28 2.6 Favored 'General case' 0 C--O 1.244 0.799 0 CA-C-O 121.133 0.492 . . . . 0.0 111.878 -173.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.547 HG22 ' HG3' ' A' ' 42' ' ' GLU . 7.1 tp -56.3 -46.88 81.78 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.36 -177.467 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.547 ' HG3' HG22 ' A' ' 41' ' ' ILE . 46.9 mt-10 -78.6 -11.82 59.99 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.412 -176.333 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -70.74 -65.89 0.68 Allowed 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 116.561 -0.29 . . . . 0.0 110.32 177.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.487 ' HA ' ' SG ' ' A' ' 47' ' ' CYS . 22.8 p-90 -73.3 -19.51 61.02 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 119.6 -0.84 . . . . 0.0 111.484 -177.003 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 11.0 mt -60.56 -42.6 92.14 Favored 'Isoleucine or valine' 0 C--O 1.236 0.384 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 167.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.8 -28.73 62.75 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.914 178.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.5 ' O ' ' HB3' ' A' ' 50' ' ' PHE . 77.3 m -66.04 -37.06 84.9 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.798 179.233 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -77.93 -26.89 49.2 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.824 177.443 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.759 ' HA ' ' HE3' ' A' ' 52' ' ' LYS . 16.0 t70 -63.78 -39.37 94.08 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.577 0.703 . . . . 0.0 109.235 169.683 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.5 ' HB3' ' O ' ' A' ' 47' ' ' CYS . 91.4 t80 -61.51 -44.56 96.85 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.668 -1.151 . . . . 0.0 109.921 175.043 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.414 ' HA ' ' O ' ' A' ' 98' ' ' LEU . 23.7 ttpp -58.68 -39.22 80.07 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.831 -177.821 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.759 ' HE3' ' HA ' ' A' ' 49' ' ' ASP . 23.2 pttp -83.82 1.59 42.32 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 120.777 0.322 . . . . 0.0 111.647 -176.55 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 14.6 m -103.35 54.35 0.76 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.76 0.79 . . . . 0.0 108.934 175.265 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.93 -4.73 2.34 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.325 -1.307 . . . . 0.0 113.807 -167.511 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -61.24 116.27 9.1 Favored Glycine 0 C--O 1.224 -0.477 0 C-N-CA 120.533 -0.841 . . . . 0.0 111.25 177.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -44.72 -47.53 11.45 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 123.419 2.746 . . . . 0.0 113.133 -173.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . 0.45 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 50.8 mt-30 -63.37 -50.66 69.06 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 121.021 0.439 . . . . 0.0 109.844 178.686 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -55.97 -37.65 69.35 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.599 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.492 HG22 ' CZ ' ' A' ' 50' ' ' PHE . 23.9 mm -57.74 -53.02 50.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.714 178.035 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 14.0 m-70 -63.38 -36.18 82.86 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.748 0.308 . . . . 0.0 110.682 -178.061 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' ' 57' ' ' GLN . 88.5 mt -64.92 -50.56 66.0 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.931 -179.72 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -69.89 -36.47 75.45 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.872 -178.236 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.76 -48.24 82.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.674 179.553 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 20.3 tptp -68.38 -29.75 68.52 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.192 -179.266 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -65.81 -61.35 2.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.076 175.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 71.2 mt -55.2 -32.99 29.26 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.168 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.581 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.456 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 77.2 t80 -54.77 -66.16 0.45 Allowed 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.535 177.789 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -76.88 -12.34 59.95 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.911 -174.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 54.3 tptt -92.82 -32.84 14.49 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.247 -177.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . 0.41 ' HB3' ' CG2' ' A' ' 79' ' ' VAL . 80.5 m-85 -133.49 -49.32 0.84 Allowed 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -172.934 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.456 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 49.8 mm -67.53 -28.25 41.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 CA-C-O 121.096 0.475 . . . . 0.0 111.071 -171.486 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.53 ' HB3' ' HB2' ' A' ' 75' ' ' ALA . 0.0 OUTLIER -65.49 125.9 26.62 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.493 178.677 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 25.0 m -58.38 -30.03 66.48 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 121.27 0.557 . . . . 0.0 110.426 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 42.1 m-20 -109.42 94.02 4.82 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 170.675 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.53 ' HB2' ' HB3' ' A' ' 72' ' ' GLN . . . -152.37 164.89 18.84 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 115.439 -0.801 . . . . 0.0 109.832 -176.244 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -46.77 -45.35 20.44 Favored 'Trans proline' 0 C--N 1.357 0.974 0 C-N-CA 122.643 2.228 . . . . 0.0 112.299 178.556 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -130.51 89.96 2.85 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 173.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.412 ' O ' ' HG2' ' A' ' 78' ' ' GLU . 0.6 OUTLIER -68.6 117.19 10.02 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.437 -179.12 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.41 ' CG2' ' HB3' ' A' ' 70' ' ' PHE . 97.3 t -69.31 138.81 21.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.615 178.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -79.45 30.72 0.23 Allowed 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.151 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.428 HD13 HG23 ' A' ' 85' ' ' THR . 39.4 tp -75.06 146.03 41.84 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.706 -175.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -53.04 145.94 12.12 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.26 -0.882 . . . . 0.0 112.052 178.569 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 39.9 p90 -66.71 -38.97 87.79 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.38 -176.336 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 79.8 t60 -69.42 -35.02 75.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.842 0.353 . . . . 0.0 110.361 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.428 HG23 HD13 ' A' ' 81' ' ' LEU . 21.4 m -70.34 -45.77 65.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.739 -179.56 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.475 ' O ' HG23 ' A' ' 90' ' ' THR . 19.3 ptpt -64.64 -31.12 72.2 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 178.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -58.73 -47.49 84.43 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.197 176.305 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 65.0 t -58.74 -43.08 87.04 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 CA-C-O 121.036 0.446 . . . . 0.0 110.284 177.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 65.0 mt -61.69 -46.9 95.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.17 -179.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.475 HG23 ' O ' ' A' ' 86' ' ' LYS . 78.8 p -60.26 -42.77 96.03 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.099 0.476 . . . . 0.0 110.864 -177.443 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -83.75 -7.01 59.57 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.96 -0.564 . . . . 0.0 112.143 -176.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 23.7 m -124.03 6.15 8.6 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 11.1 tp -67.25 -21.39 27.89 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 CA-C-O 120.999 0.428 . . . . 0.0 110.464 -178.031 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 9.9 t -58.73 -36.87 75.0 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.169 178.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -141.46 83.95 12.92 Favored Pre-proline 0 C--O 1.233 0.197 0 CA-C-O 120.953 0.406 . . . . 0.0 110.23 -179.379 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . 0.437 ' HG2' HG23 ' A' ' 59' ' ' ILE . 86.2 Cg_endo -81.55 156.56 18.87 Favored 'Trans proline' 0 CA--C 1.532 0.411 0 C-N-CA 122.714 2.276 . . . . 0.0 112.298 178.771 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' THR . . . . . 0.4 ' H ' ' HB2' ' A' ' 100' ' ' SER . 62.8 p -86.78 -171.82 3.71 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.575 176.594 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . 0.414 ' O ' ' HA ' ' A' ' 51' ' ' LYS . 34.8 tp -51.04 -37.43 45.35 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.189 0.519 . . . . 0.0 110.847 -177.621 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -152.29 76.84 1.18 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.586 0.708 . . . . 0.0 109.537 170.803 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' SER . . . . . 0.4 ' HB2' ' H ' ' A' ' 97' ' ' THR . 13.1 t -58.83 -19.33 40.42 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 115.172 -0.922 . . . . 0.0 111.485 -176.346 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 75.9 m-85 -77.31 6.22 7.19 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.868 -179.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -52.16 -50.86 60.95 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 122.966 0.506 . . . . 0.0 111.034 177.631 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.4 ' O ' ' HD3' ' A' ' 107' ' ' ARG . . . -61.05 -42.58 98.75 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.535 179.253 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.19 -43.25 99.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.616 179.033 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 25.4 tt0 -54.53 -44.44 72.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.373 177.786 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' SER . . . . . 0.443 ' O ' ' HG2' ' A' ' 110' ' ' GLN . 32.1 m -56.96 -47.47 80.62 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.512 179.712 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . 0.444 ' O ' ' HG ' ' A' ' 111' ' ' LEU . 12.5 mpt_? -62.9 -63.93 1.06 Allowed 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.548 178.602 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.472 ' O ' ' HG3' ' A' ' 112' ' ' MET . 80.2 t -50.82 -42.45 23.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.435 -175.0 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . 0.587 ' HA ' ' HE1' ' A' ' 112' ' ' MET . 32.5 t80 -56.99 -59.53 4.92 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.119 179.159 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.443 ' HG2' ' O ' ' A' ' 106' ' ' SER . 4.1 pt20 -71.26 -20.56 62.21 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 120.553 0.216 . . . . 0.0 111.455 -174.854 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 107' ' ' ARG . 76.3 mt -69.65 -41.11 76.0 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.805 -0.18 . . . . 0.0 111.006 178.76 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' MET . . . . . 0.587 ' HE1' ' HA ' ' A' ' 109' ' ' TYR . 0.0 OUTLIER -91.55 -12.02 35.63 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 120.955 -0.298 . . . . 0.0 110.79 178.932 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . 0.494 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 42.5 tt0 -68.05 -56.71 7.88 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 171.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -58.28 -22.88 54.35 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.226 -176.157 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -110.91 -69.28 0.88 Allowed 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 120.976 0.417 . . . . 0.0 111.089 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' SER . . . . . 0.442 ' HA ' ' HB3' ' A' ' 119' ' ' ARG . 22.1 m -69.58 -17.92 63.59 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 -168.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . 0.494 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 22.5 t80 -68.46 -60.44 2.43 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 118.116 0.417 . . . . 0.0 110.431 177.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 20.6 p -65.12 -34.47 78.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.314 0.578 . . . . 0.0 110.272 178.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . 0.442 ' HB3' ' HA ' ' A' ' 116' ' ' SER . 16.3 ttt180 -55.29 -46.8 76.2 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 114.953 -1.021 . . . . 0.0 109.472 173.313 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -65.62 -41.5 92.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.346 177.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 90.5 mt -58.21 -25.57 61.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.633 0.254 . . . . 0.0 111.21 -179.452 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 11.4 mptt -113.65 7.96 17.44 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 179.083 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 78.4 p -69.41 140.77 54.17 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 171.289 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -54.43 -33.49 59.58 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 111.522 0.193 . . . . 0.0 111.522 -179.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 9.9 tp -66.31 -40.81 87.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 CA-C-O 120.743 0.306 . . . . 0.0 110.878 -178.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' TYR . . . . . 0.521 ' O ' ' HG2' ' A' ' 130' ' ' MET . 84.7 t80 -72.17 -43.24 64.89 Favored 'General case' 0 C--O 1.232 0.176 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 176.349 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 91.4 mt -61.86 -23.79 66.5 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.199 177.351 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -68.58 -43.56 76.26 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.133 173.094 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 80.9 mt -61.65 -29.4 70.04 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.242 176.338 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' MET . . . . . 0.78 ' SD ' HG11 ' A' ' 9' ' ' VAL . 19.4 mmt -79.43 -65.27 1.02 Allowed 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.632 0.73 . . . . 0.0 110.498 -179.529 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -104.57 -34.65 8.12 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 114.773 -1.103 . . . . 0.0 112.177 -168.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 96.39 88.03 1.8 Allowed Glycine 0 C--O 1.237 0.326 0 N-CA-C 110.558 -1.017 . . . . 0.0 110.558 -171.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 37.2 ttm180 -146.98 129.06 7.57 Favored Pre-proline 0 C--N 1.328 -0.369 0 C-N-CA 121.977 0.111 . . . . 0.0 111.012 -169.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_exo . . . . . 0 C--N 1.348 0.527 0 C-N-CA 122.798 2.332 . . . . 0.0 111.684 173.944 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 17.0 m . . . . . 0 N--CA 1.476 0.866 0 N-CA-C 109.708 -0.479 . . . . 0.0 109.708 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 16.5 ptp -77.05 70.77 3.49 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 121.267 0.556 . . . . 0.0 111.491 -176.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 3.2 p -62.38 123.17 14.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.937 175.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 17.6 m -62.13 136.24 95.28 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.109 179.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.432 ' O ' HG12 ' A' ' 9' ' ' VAL . 8.2 Cg_endo -49.72 -26.77 13.81 Favored 'Trans proline' 0 C--N 1.355 0.872 0 C-N-CA 123.186 2.591 . . . . 0.0 112.464 -178.149 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.577 ' O ' ' HG2' ' A' ' 10' ' ' LYS . 32.8 tt0 -58.53 -58.06 10.2 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.16 176.168 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -59.25 -37.1 76.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.252 0.548 . . . . 0.0 110.187 175.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.5 -39.75 94.5 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.663 -177.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.554 HG21 ' O ' ' A' ' 6' ' ' GLU . 27.0 m -72.1 -26.58 25.3 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.297 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.261 178.011 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.577 ' HG2' ' O ' ' A' ' 6' ' ' GLU . 14.4 mmmm -63.31 -38.15 90.03 Favored 'General case' 0 N--CA 1.463 0.207 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 174.702 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 54.0 m0 -61.33 -29.65 70.02 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.634 176.168 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -74.42 6.96 20.49 Favored Glycine 0 CA--C 1.521 0.443 0 CA-C-N 115.64 -0.709 . . . . 0.0 113.719 -176.308 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.497 ' HG3' ' O ' ' A' ' 10' ' ' LYS . 0.0 OUTLIER -132.49 12.0 4.5 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 117.475 0.638 . . . . 0.0 111.244 176.391 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.432 ' HB3' ' HG2' ' A' ' 17' ' ' LYS . 44.2 t -171.0 100.59 0.21 Allowed 'General case' 0 C--O 1.237 0.444 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.169 176.863 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.414 ' HD1' HD22 ' A' ' 18' ' ' LEU . 37.0 t80 -55.12 -29.02 56.82 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.36 176.418 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -57.59 -52.06 66.94 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.994 -179.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.432 ' HG2' ' HB3' ' A' ' 14' ' ' SER . 17.7 ptpt -74.42 -28.39 61.05 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 120.946 -0.302 . . . . 0.0 110.533 -174.837 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.414 HD22 ' HD1' ' A' ' 15' ' ' PHE . 16.4 tp -57.19 -51.36 69.62 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.018 173.893 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.531 HD12 ' HA ' ' A' ' 25' ' ' LEU . 15.7 tp -82.9 -22.54 33.9 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.821 -175.508 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 23.2 t -76.71 -25.73 53.91 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.278 178.21 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -73.59 120.87 19.79 Favored 'General case' 0 C--O 1.222 -0.347 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 177.911 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.433 ' O ' ' HB3' ' A' ' 25' ' ' LEU . 60.9 mtp180 -43.06 -56.65 3.25 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.226 0.61 . . . . 0.0 112.551 -173.718 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -72.56 -26.52 61.76 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.816 0.341 . . . . 0.0 110.469 -178.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -68.17 -34.55 81.18 Favored Glycine 0 C--N 1.333 0.397 0 N-CA-C 111.384 -0.686 . . . . 0.0 111.384 176.325 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.531 ' HA ' HD12 ' A' ' 19' ' ' LEU . 9.3 tp -58.31 -54.72 43.83 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.536 0.684 . . . . 0.0 109.505 174.423 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.468 ' O ' ' HG2' ' A' ' 30' ' ' ARG . 8.8 tp10 -61.59 -34.58 75.86 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 114.715 -1.13 . . . . 0.0 110.459 -179.408 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.538 ' O ' ' HB2' ' A' ' 30' ' ' ARG . . . -68.28 -52.25 35.87 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 121.053 0.454 . . . . 0.0 111.153 179.323 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -64.75 -39.54 93.8 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.656 -177.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.532 ' OG1' ' HE2' ' A' ' 33' ' ' LYS . 3.6 t -64.31 -33.25 75.4 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 -179.482 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.538 ' HB2' ' O ' ' A' ' 27' ' ' ALA . 67.1 mmt-85 -52.43 -51.2 60.4 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.295 0.569 . . . . 0.0 109.556 171.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.463 ' O ' HG23 ' A' ' 34' ' ' THR . 69.2 t80 -64.56 -46.81 81.19 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 114.991 -1.004 . . . . 0.0 110.864 -178.158 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.516 HD22 ' HB2' ' A' ' 40' ' ' ASN . 23.1 tp -70.48 -23.23 62.64 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.418 -175.583 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.566 ' HZ1' ' HG3' ' A' ' 38' ' ' GLU . 68.4 mttm -86.1 -34.15 20.73 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.771 -0.195 . . . . 0.0 110.964 178.53 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.463 HG23 ' O ' ' A' ' 31' ' ' PHE . 14.3 t -72.37 -22.94 61.07 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 121.08 -0.248 . . . . 0.0 110.854 -178.202 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.418 ' CD ' HH12 ' A' ' 119' ' ' ARG . 12.6 pt-20 -88.27 5.04 43.66 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 120.978 0.418 . . . . 0.0 110.028 174.088 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 33.0 t80 68.7 26.93 6.05 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.63 174.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 50.1 m -91.96 -78.52 0.4 Allowed 'General case' 0 CA--C 1.532 0.264 0 O-C-N 122.06 -0.4 . . . . 0.0 110.016 176.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.566 ' HG3' ' HZ1' ' A' ' 33' ' ' LYS . 32.8 tt0 67.37 -64.61 0.25 Allowed 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 112.959 0.726 . . . . 0.0 112.959 175.667 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -39.32 -38.95 0.58 Allowed 'General case' 0 C--O 1.22 -0.484 0 C-N-CA 123.899 0.88 . . . . 0.0 113.061 -174.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.516 ' HB2' HD22 ' A' ' 32' ' ' LEU . 43.2 m-80 -50.43 -68.89 0.13 Allowed 'General case' 0 C--O 1.242 0.665 0 CA-C-O 121.062 0.458 . . . . 0.0 111.879 -176.668 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.433 HD13 HD13 ' A' ' 19' ' ' LEU . 3.7 tt -61.95 -44.33 98.76 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.857 -176.346 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -62.89 -31.59 72.68 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.081 -179.053 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 66.2 t80 -65.29 -66.71 0.51 Allowed 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.353 -177.209 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.506 ' HE1' ' HE3' ' A' ' 112' ' ' MET . 33.6 p-90 -71.23 -23.97 62.1 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 119.707 -0.797 . . . . 0.0 111.805 -171.957 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 14.7 tt -66.85 -36.26 76.75 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 C-N-CA 120.213 -0.595 . . . . 0.0 109.592 177.1 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.0 -33.09 75.02 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 121.26 0.552 . . . . 0.0 109.887 173.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 72.5 m -70.4 -29.16 65.72 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.364 177.131 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.556 ' O ' ' HG3' ' A' ' 52' ' ' LYS . 37.0 mm-40 -72.93 -30.86 64.22 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 116.671 -0.24 . . . . 0.0 110.517 177.162 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.794 ' HA ' ' HE3' ' A' ' 52' ' ' LYS . 30.3 t70 -61.08 -42.18 98.03 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 172.126 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -63.46 -35.81 81.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.048 174.092 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.521 ' HB2' ' HA ' ' A' ' 48' ' ' GLU . 1.1 tppp? -59.28 -29.45 67.6 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.964 178.136 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.794 ' HE3' ' HA ' ' A' ' 49' ' ' ASP . 9.4 mtmp? -87.46 -19.6 27.77 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.104 -179.03 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 18.8 m -73.36 82.09 1.4 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.343 0.592 . . . . 0.0 111.102 -173.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.442 ' HD3' ' O ' ' A' ' 54' ' ' LYS . 0.0 OUTLIER -76.02 103.85 6.27 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.84 178.326 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . 0.515 ' O ' HG12 ' A' ' 59' ' ' ILE . . . 173.1 119.84 0.54 Allowed Glycine 0 N--CA 1.45 -0.406 0 N-CA-C 110.93 -0.868 . . . . 0.0 110.93 178.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_endo -55.35 -46.77 30.04 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.74 2.293 . . . . 0.0 112.348 -174.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . 0.421 ' NE2' HE21 ' A' ' 58' ' ' GLN . 7.9 pm0 -67.75 -34.46 76.86 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.192 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.421 HE21 ' NE2' ' A' ' 57' ' ' GLN . 66.5 mm-40 -63.38 -40.76 98.11 Favored 'General case' 0 N--CA 1.462 0.14 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 179.149 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.515 HG12 ' O ' ' A' ' 55' ' ' GLY . 47.3 mm -54.51 -42.03 57.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.907 -179.663 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 32.5 m-70 -67.57 -56.1 10.78 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.194 -178.161 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.467 HD12 ' N ' ' A' ' 62' ' ' LYS . 3.9 pp -73.2 -34.46 65.98 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 112.534 0.568 . . . . 0.0 112.534 -171.191 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.467 ' N ' HD12 ' A' ' 61' ' ' LEU . 47.1 mtpt -75.95 -40.72 53.41 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 120.869 -0.333 . . . . 0.0 110.675 179.506 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.15 -41.71 97.07 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.879 0.371 . . . . 0.0 110.228 177.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 15.9 tppt? -60.39 -41.51 93.97 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.855 177.314 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.26 -49.4 77.22 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.934 179.159 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 68.8 mt -64.95 -35.76 76.16 Favored 'Isoleucine or valine' 0 C--O 1.234 0.273 0 CA-C-O 121.229 0.538 . . . . 0.0 110.35 178.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 74.0 t80 -57.88 -63.14 1.35 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.875 -179.078 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -68.96 -29.27 67.46 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.914 -173.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 64.9 tttm -94.93 -17.22 22.19 Favored 'General case' 0 C--O 1.237 0.423 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -172.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 99.2 m-85 -133.29 -52.16 0.89 Allowed 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 112.311 0.485 . . . . 0.0 112.311 -177.185 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 50.3 mm -67.03 -44.11 88.53 Favored 'Isoleucine or valine' 0 C--O 1.238 0.45 0 CA-C-O 120.886 0.374 . . . . 0.0 111.417 -172.048 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.422 ' HG3' ' H ' ' A' ' 74' ' ' ASP . 6.3 tp-100 -72.12 145.17 48.32 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.889 -174.624 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.406 ' O ' HG23 ' A' ' 73' ' ' THR . 13.2 m -85.78 27.45 0.86 Allowed 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 121.952 0.882 . . . . 0.0 110.36 178.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.422 ' H ' ' HG3' ' A' ' 72' ' ' GLN . 13.9 m-20 -128.83 20.96 5.94 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 174.018 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -86.33 159.38 53.49 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 114.988 -1.006 . . . . 0.0 111.837 -171.139 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_endo -85.65 11.63 3.29 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.964 2.443 . . . . 0.0 111.973 177.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.644 ' HA ' ' HE2' ' A' ' 77' ' ' LYS . 0.4 OUTLIER -128.57 -44.41 1.37 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.242 178.394 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 64.52 97.63 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.581 178.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 58.2 t -101.3 134.18 42.33 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.271 177.163 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 38.5 m-80 -83.48 27.32 0.61 Allowed 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.538 -176.182 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 9.4 tp -57.45 143.28 41.02 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.552 174.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -46.69 128.64 10.8 Favored 'General case' 0 C--O 1.237 0.446 0 O-C-N 123.892 0.745 . . . . 0.0 111.7 -175.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -59.22 -45.75 90.28 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.196 -175.046 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . 0.466 ' O ' ' HB3' ' A' ' 87' ' ' GLU . 54.0 t60 -61.15 -29.63 69.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.898 179.662 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 28.2 m -71.34 -49.41 42.74 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.746 179.075 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.517 ' O ' HG23 ' A' ' 90' ' ' THR . 17.8 ptpt -66.95 -23.22 65.93 Favored 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 120.816 -0.353 . . . . 0.0 110.081 179.769 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.466 ' HB3' ' O ' ' A' ' 84' ' ' HIS . 41.1 tt0 -58.29 -53.09 62.19 Favored 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 171.196 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 58.5 t -58.88 -41.22 82.28 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.335 176.556 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 69.3 mt -60.41 -43.94 95.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.233 -179.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.517 HG23 ' O ' ' A' ' 86' ' ' LYS . 76.4 p -61.9 -31.68 72.0 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.214 0.53 . . . . 0.0 110.147 178.904 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . 0.473 ' N ' HD21 ' A' ' 91' ' ' ASN . 0.9 OUTLIER -79.95 -16.94 54.23 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.209 179.165 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 20.3 m -108.79 -14.24 14.63 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -176.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.0 tp -64.49 -21.61 29.51 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -170.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 7.7 t -57.01 -44.99 83.34 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 120.999 0.428 . . . . 0.0 110.368 177.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 -149.64 80.77 7.41 Favored Pre-proline 0 C--O 1.238 0.47 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 178.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . 0.505 ' HG2' HG23 ' A' ' 59' ' ' ILE . 74.1 Cg_endo -75.42 -161.67 0.13 Allowed 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 123.058 2.505 . . . . 0.0 112.591 -176.368 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 9.4 m -152.49 165.73 34.18 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.671 -176.198 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -47.32 -60.72 2.31 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 122.644 0.378 . . . . 0.0 111.489 -177.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . 0.459 ' ND1' ' HD2' ' A' ' 51' ' ' LYS . 77.0 m-70 -95.32 24.54 4.98 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.548 -0.297 . . . . 0.0 111.51 -177.085 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 41.4 t -66.24 -40.15 90.05 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.268 0.556 . . . . 0.0 109.724 176.356 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 81.7 m-85 -88.02 6.91 33.75 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.911 179.1 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . 0.501 ' O ' ' HB3' ' A' ' 105' ' ' GLN . 9.5 t70 -70.54 -33.88 71.64 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 178.255 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.574 ' O ' ' HG2' ' A' ' 107' ' ' ARG . . . -61.99 -42.51 99.23 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.629 173.561 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.05 -41.03 86.9 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.064 176.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.501 ' HB3' ' O ' ' A' ' 102' ' ' ASP . 25.4 tt0 -53.24 -53.94 43.43 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.954 174.232 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 42.7 t -51.72 -44.98 63.41 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.253 -177.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . 0.574 ' HG2' ' O ' ' A' ' 103' ' ' ALA . 19.9 mmm180 -62.8 -50.72 69.88 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 120.937 0.398 . . . . 0.0 111.076 -175.49 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 90.7 t -71.52 -42.76 72.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.925 -177.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 59.8 t80 -58.12 -53.21 60.8 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.525 179.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.533 ' O ' ' HG2' ' A' ' 114' ' ' GLN . 0.0 OUTLIER -64.98 -32.05 73.59 Favored 'General case' 0 N--CA 1.461 0.091 0 N-CA-C 110.159 -0.312 . . . . 0.0 110.159 -178.994 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 58.2 tp -62.14 -62.32 1.86 Allowed 'General case' 0 N--CA 1.46 0.053 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.549 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' MET . . . . . 0.506 ' HE3' ' HE1' ' A' ' 44' ' ' TRP . 25.4 ptt? -67.72 -21.55 65.29 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-O 120.747 0.308 . . . . 0.0 110.43 -178.443 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . 0.523 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 42.6 tt0 -64.22 -55.55 20.79 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 174.723 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . 0.533 ' HG2' ' O ' ' A' ' 110' ' ' GLN . 12.6 pt20 -77.5 -18.43 57.08 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.774 -177.046 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -114.96 3.9 14.64 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 -175.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' SER . . . . . 0.461 ' HB3' ' O ' ' A' ' 112' ' ' MET . 32.2 t -147.03 -43.53 0.18 Allowed 'General case' 0 N--CA 1.466 0.339 0 O-C-N 122.068 -0.395 . . . . 0.0 111.442 177.726 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . 0.523 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 32.4 t80 -65.93 -40.3 91.29 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 120.913 0.387 . . . . 0.0 110.579 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 29.9 p -56.73 -55.01 39.67 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-O 121.665 0.745 . . . . 0.0 110.035 174.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . 0.418 HH12 ' CD ' ' A' ' 35' ' ' GLU . 27.1 mtp180 -58.2 -35.34 71.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 114.881 -1.054 . . . . 0.0 110.863 176.558 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 79.4 t80 -60.71 -45.3 94.77 Favored 'General case' 0 C--O 1.224 -0.282 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 179.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 87.4 mt -63.67 -23.58 67.43 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.954 0.407 . . . . 0.0 110.471 177.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -101.43 0.77 37.44 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.17 -0.468 . . . . 0.0 112.255 179.054 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 76.6 p -76.58 147.08 37.89 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 120.627 0.251 . . . . 0.0 110.513 -176.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -58.21 -31.17 67.08 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 175.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 43.7 mm -56.69 -48.94 79.99 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 CA-C-N 115.144 -0.935 . . . . 0.0 110.631 175.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' TYR . . . . . 0.411 ' O ' ' HG2' ' A' ' 130' ' ' MET . 88.4 t80 -66.43 -43.66 85.04 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.572 -179.252 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -62.14 -34.12 75.76 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.408 178.114 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -64.36 -35.24 80.25 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.061 175.023 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 99.6 mt -76.53 -25.69 54.41 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.84 177.328 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' MET . . . . . 0.741 ' HA ' ' HE3' ' A' ' 130' ' ' MET . 12.7 mmt -71.07 -43.97 66.69 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.338 178.254 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 57.77 17.89 4.47 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.295 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . -88.3 6.65 83.3 Favored Glycine 0 CA--C 1.519 0.322 0 CA-C-N 116.186 -0.461 . . . . 0.0 113.262 -175.409 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 68.3 mtt-85 60.26 91.52 0.08 OUTLIER Pre-proline 0 CA--C 1.537 0.45 0 C-N-CA 122.77 0.428 . . . . 0.0 111.031 -179.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo . . . . . 0 C--N 1.348 0.534 0 C-N-CA 122.866 2.377 . . . . 0.0 113.01 -176.924 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 50.4 m . . . . . 0 N--CA 1.477 0.92 0 CA-C-O 120.519 0.199 . . . . 0.0 110.552 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 26.5 mmt -110.74 -170.11 1.58 Allowed 'General case' 0 C--O 1.236 0.351 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 177.369 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . 0.506 HG23 ' CZ2' ' A' ' 11' ' ' TRP . 8.9 p -61.38 142.35 16.29 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 CA-C-O 120.926 0.393 . . . . 0.0 111.264 178.064 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.4 m -91.9 148.81 37.79 Favored Pre-proline 0 CA--C 1.534 0.362 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.059 177.067 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -50.38 -36.49 48.19 Favored 'Trans proline' 0 C--N 1.353 0.768 0 C-N-CA 123.078 2.518 . . . . 0.0 113.007 -176.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.54 ' O ' HG21 ' A' ' 9' ' ' VAL . 1.0 OUTLIER -65.65 -41.07 92.99 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 121.473 0.654 . . . . 0.0 110.029 179.844 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.515 ' O ' ' HB2' ' A' ' 10' ' ' LYS . 2.6 tm-20 -69.64 -30.27 67.93 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 178.283 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.83 -44.54 80.86 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.067 178.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.648 HG13 ' SD ' ' A' ' 130' ' ' MET . 17.5 m -66.3 -26.07 37.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 CA-C-O 120.942 0.401 . . . . 0.0 110.39 179.495 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.53 ' O ' ' HG2' ' A' ' 13' ' ' GLU . 41.5 mmtm -57.89 -34.56 69.93 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.984 175.038 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . 0.506 ' CZ2' HG23 ' A' ' 3' ' ' VAL . 43.1 m0 -60.08 -32.43 70.95 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 120.871 0.367 . . . . 0.0 110.946 -179.142 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -65.19 -3.15 10.88 Favored Glycine 0 CA--C 1.521 0.448 0 CA-C-N 115.667 -0.697 . . . . 0.0 114.477 -171.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.53 ' HG2' ' O ' ' A' ' 10' ' ' LYS . 13.4 pt-20 -91.35 -32.52 15.65 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 117.68 0.74 . . . . 0.0 110.897 179.406 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 51.8 m -150.37 123.58 8.89 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.022 -174.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.482 ' HZ ' ' SD ' ' A' ' 112' ' ' MET . 17.9 t80 -58.92 -32.48 69.6 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.984 176.55 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -54.46 -43.73 71.94 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.904 175.253 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -67.59 -42.58 82.26 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.343 179.103 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 68.2 tp -54.44 -38.98 66.93 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.17 177.199 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 53.1 tp -75.11 -28.4 60.21 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.027 179.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 38.4 m -68.23 -36.18 79.1 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.258 -177.396 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -86.77 121.5 29.36 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 179.748 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.6 ptm180 -58.08 -28.21 64.36 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.118 0.485 . . . . 0.0 110.292 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -61.75 -49.6 75.76 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.36 174.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -63.68 -44.67 96.04 Favored Glycine 0 C--N 1.335 0.492 0 CA-C-N 115.018 -0.992 . . . . 0.0 111.778 179.447 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 15.3 tp -48.7 -60.39 2.76 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 123.018 0.527 . . . . 0.0 111.072 177.314 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.467 ' O ' ' HB2' ' A' ' 30' ' ' ARG . 11.1 tp10 -59.01 -50.01 75.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.874 -175.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -60.68 -35.13 75.51 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 121.053 0.454 . . . . 0.0 111.106 -179.084 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 91.9 t80 -75.08 -46.3 35.59 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.861 -176.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.584 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 11.9 t -70.75 -27.8 64.22 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 -176.164 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.467 ' HB2' ' O ' ' A' ' 26' ' ' GLU . 0.2 OUTLIER -61.83 -54.73 38.14 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.191 -0.913 . . . . 0.0 109.863 177.714 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.489 ' O ' ' HB ' ' A' ' 34' ' ' THR . 86.9 t80 -57.62 -34.06 68.9 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.178 0.513 . . . . 0.0 110.653 -179.087 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 26.7 tp -74.81 -45.99 39.81 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.947 -178.242 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.584 ' HG3' ' O ' ' A' ' 29' ' ' THR . 68.3 mttm -60.95 -25.4 66.79 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.232 0.539 . . . . 0.0 110.002 177.211 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.489 ' HB ' ' O ' ' A' ' 31' ' ' PHE . 96.4 m -60.77 -35.31 76.09 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.263 177.691 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -101.89 9.78 40.34 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 120.986 0.422 . . . . 0.0 110.481 176.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 83.6 m-85 66.23 8.26 5.45 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.478 -0.783 . . . . 0.0 112.572 173.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 21.4 t -92.81 43.33 1.12 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.191 0.52 . . . . 0.0 109.751 -178.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -86.4 2.03 49.11 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.746 -174.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.35 -31.57 72.83 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -175.935 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.614 ' OD1' ' HE1' ' A' ' 112' ' ' MET . 6.2 p30 -69.25 -57.99 4.63 Favored 'General case' 0 C--O 1.246 0.88 0 N-CA-C 111.969 0.359 . . . . 0.0 111.969 -176.38 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.421 ' O ' HG13 ' A' ' 45' ' ' ILE . 13.8 tt -63.0 -46.81 95.36 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-O 120.574 0.226 . . . . 0.0 110.477 -177.184 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -62.99 -24.5 67.94 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.066 177.681 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.454 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 82.9 t80 -62.75 -63.2 1.28 Allowed 'General case' 0 C--O 1.235 0.312 0 C-N-CA 121.399 -0.121 . . . . 0.0 111.022 179.552 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.599 ' HE1' ' HE2' ' A' ' 112' ' ' MET . 20.9 p-90 -70.97 -19.86 62.5 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 119.439 -0.904 . . . . 0.0 111.468 -175.146 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.421 HG13 ' O ' ' A' ' 41' ' ' ILE . 66.3 mt -67.33 -51.05 56.84 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 CA-C-O 121.293 0.568 . . . . 0.0 109.786 170.846 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.39 -28.6 69.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.514 178.693 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.608 ' SG ' ' HB2' ' A' ' 101' ' ' PHE . 41.0 t -68.58 -33.43 74.05 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.583 -179.722 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.709 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 10.5 pt-20 -83.29 -25.69 31.33 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 120.444 -0.503 . . . . 0.0 110.318 176.661 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.474 ' HA ' ' HE3' ' A' ' 52' ' ' LYS . 18.1 t70 -62.57 -33.37 74.82 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 168.81 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -71.62 -56.12 6.45 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 114.632 -1.167 . . . . 0.0 111.121 174.599 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.709 ' HG2' ' HA ' ' A' ' 48' ' ' GLU . 25.4 pttm -85.03 11.49 9.47 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -171.4 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.474 ' HE3' ' HA ' ' A' ' 49' ' ' ASP . 18.5 ptpt -88.67 -24.19 22.82 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 168.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 17.3 p -90.25 122.03 32.81 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 174.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -100.13 6.16 44.89 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.623 -172.259 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . 0.438 ' O ' HG12 ' A' ' 59' ' ' ILE . . . -67.09 123.03 20.59 Favored Glycine 0 CA--C 1.519 0.309 0 C-N-CA 121.015 -0.612 . . . . 0.0 112.013 179.187 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.467 ' O ' ' HD2' ' A' ' 60' ' ' HIS . 12.2 Cg_endo -54.05 -46.91 30.12 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.671 2.248 . . . . 0.0 112.067 -177.922 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 82.0 mm-40 -64.29 -40.52 96.13 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 121.346 0.593 . . . . 0.0 109.845 178.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.444 ' OE1' HD12 ' A' ' 61' ' ' LEU . 6.5 tp-100 -58.66 -43.29 89.82 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 114.829 -1.078 . . . . 0.0 110.557 -179.116 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.438 HG12 ' O ' ' A' ' 55' ' ' GLY . 42.3 mm -57.29 -49.5 79.75 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.212 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.809 -178.055 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.467 ' HD2' ' O ' ' A' ' 56' ' ' PRO . 74.8 m-70 -64.45 -54.3 34.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.596 -0.275 . . . . 0.0 111.563 -173.933 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.504 HD11 ' N ' ' A' ' 62' ' ' LYS . 4.2 pp -64.48 -31.83 73.21 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.624 0.249 . . . . 0.0 111.648 -175.88 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.504 ' N ' HD11 ' A' ' 61' ' ' LEU . 36.3 mmtm -71.49 -53.16 14.82 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 120.629 0.252 . . . . 0.0 110.544 176.414 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.69 -38.08 74.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.885 -178.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 27.6 tptp -65.49 -41.26 93.46 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.232 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -64.84 -50.81 65.21 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.687 178.463 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 70.6 mt -58.58 -36.56 60.26 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.206 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.198 178.42 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.443 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 91.6 t80 -56.01 -63.65 1.11 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.674 178.327 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -64.4 -35.34 80.6 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.752 -0.658 . . . . 0.0 112.04 -174.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 80.9 tttt -90.32 -25.84 20.29 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -170.195 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -127.15 -48.36 1.46 Allowed 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -174.272 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.443 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 48.4 mm -70.56 -38.37 73.24 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 CA-C-O 120.947 0.403 . . . . 0.0 111.19 -173.396 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.492 ' HB3' ' HB2' ' A' ' 75' ' ' ALA . 6.2 tp-100 -61.04 141.37 57.44 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.106 -176.402 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 28.8 m -73.59 -35.06 65.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.237 0.541 . . . . 0.0 110.73 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -93.68 27.66 2.6 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.206 0.527 . . . . 0.0 110.501 175.098 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.492 ' HB2' ' HB3' ' A' ' 72' ' ' GLN . . . -70.93 160.64 81.67 Favored Pre-proline 0 C--O 1.235 0.341 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.49 176.489 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.49 ' HD2' ' HB3' ' A' ' 75' ' ' ALA . 12.2 Cg_endo -55.1 -35.03 89.58 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.799 2.332 . . . . 0.0 112.268 -179.097 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.42 ' O ' ' HB3' ' A' ' 78' ' ' GLU . 33.6 mtmm -122.95 -50.27 1.94 Allowed 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.826 176.895 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.42 ' HB3' ' O ' ' A' ' 77' ' ' LYS . 44.0 tt0 68.9 139.81 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.375 0 O-C-N 123.698 0.623 . . . . 0.0 110.803 -175.132 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.44 ' C ' ' H ' ' A' ' 81' ' ' LEU . 60.8 t -95.44 149.15 4.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.427 175.495 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 41.8 m-80 -70.68 17.24 0.07 Allowed 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 -177.642 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.562 HD11 HG21 ' A' ' 85' ' ' THR . 47.4 tp -60.97 144.07 53.96 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 122.746 0.418 . . . . 0.0 110.822 176.647 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -54.92 143.38 26.33 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.744 -177.054 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.43 ' HA ' ' HG2' ' A' ' 86' ' ' LYS . 89.9 t80 -62.23 -44.7 95.96 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.872 -178.673 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . 0.407 ' O ' HG22 ' A' ' 88' ' ' VAL . 82.0 t60 -66.87 -30.31 70.44 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.567 0.222 . . . . 0.0 110.749 -178.915 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.562 HG21 HD11 ' A' ' 81' ' ' LEU . 27.1 m -69.29 -48.18 62.37 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 177.84 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.499 ' O ' HG22 ' A' ' 90' ' ' THR . 19.0 ptpt -65.97 -28.36 68.84 Favored 'General case' 0 N--CA 1.462 0.129 0 N-CA-C 109.754 -0.462 . . . . 0.0 109.754 178.011 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -60.18 -49.31 78.12 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.148 177.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.407 HG22 ' O ' ' A' ' 84' ' ' HIS . 58.3 t -56.4 -40.82 69.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 121.253 0.549 . . . . 0.0 109.678 176.209 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 72.3 mt -63.9 -42.62 96.41 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.968 178.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.499 HG22 ' O ' ' A' ' 86' ' ' LYS . 67.9 p -62.61 -25.35 68.05 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.891 0.377 . . . . 0.0 110.9 -178.126 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 57.4 m-80 -90.59 -23.74 20.76 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.252 178.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 31.1 t -98.22 -9.64 25.31 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.63 -176.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 9.4 tp -60.89 -26.14 37.81 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 N-CA-C 112.003 0.371 . . . . 0.0 112.003 -174.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 12.3 t -68.57 -24.41 64.6 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 120.83 0.348 . . . . 0.0 110.791 -179.191 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -144.68 76.05 14.34 Favored Pre-proline 0 CA--C 1.532 0.268 0 CA-C-N 116.213 -0.448 . . . . 0.0 109.907 179.466 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -82.3 153.22 16.12 Favored 'Trans proline' 0 C--O 1.237 0.45 0 C-N-CA 122.671 2.247 . . . . 0.0 112.484 -178.118 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 47.8 p -111.3 174.09 6.03 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.228 176.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 34.7 tp -57.78 -57.27 13.49 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.371 0.605 . . . . 0.0 111.111 -178.297 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . 0.439 ' HD1' ' HB3' ' A' ' 102' ' ' ASP . 1.2 t-80 -95.85 12.65 29.42 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.326 -171.861 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 22.7 p -44.26 -47.42 9.4 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -172.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.608 ' HB2' ' SG ' ' A' ' 47' ' ' CYS . 99.0 m-85 -78.85 11.61 2.56 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.244 0.831 . . . . 0.0 113.244 -171.892 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . 0.44 ' HA ' ' HG2' ' A' ' 105' ' ' GLN . 8.6 p30 -60.47 -38.68 85.03 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 118.189 0.45 . . . . 0.0 111.545 -177.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.07 -38.76 83.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.191 0.519 . . . . 0.0 110.372 176.021 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.8 -36.16 79.92 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.801 -179.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.487 ' HG2' ' O ' ' A' ' 101' ' ' PHE . 13.0 mm-40 -56.87 -49.17 76.31 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.308 0.575 . . . . 0.0 109.569 179.822 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 45.2 t -59.12 -49.11 79.14 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.04 -0.982 . . . . 0.0 110.923 -179.024 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 28.1 mmm180 -59.46 -47.33 85.9 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.242 -177.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.424 HG21 ' CD2' ' A' ' 43' ' ' PHE . 88.6 t -66.61 -41.54 88.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.156 -178.623 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 65.1 t80 -64.86 -43.43 93.0 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.361 -177.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 5.3 pp0? -69.58 -37.25 76.87 Favored 'General case' 0 C--O 1.239 0.512 0 N-CA-C 111.535 0.198 . . . . 0.0 111.535 -175.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 4.5 pp -73.58 -24.84 60.13 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-O 120.836 0.35 . . . . 0.0 110.2 179.23 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' MET . . . . . 0.614 ' HE1' ' OD1' ' A' ' 40' ' ' ASN . 34.4 ttm -66.38 -50.17 64.39 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.771 -0.65 . . . . 0.0 109.997 175.136 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . 0.565 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 38.2 tt0 -54.88 -57.86 9.91 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.081 -178.127 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -60.88 -9.38 4.08 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 112.963 0.727 . . . . 0.0 112.963 -172.028 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . 0.464 ' O ' ' HG3' ' A' ' 119' ' ' ARG . 32.9 t70 -126.93 -68.85 0.78 Allowed 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 120.61 0.243 . . . . 0.0 111.087 178.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 22.7 t -60.96 -38.38 85.69 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 111.697 0.258 . . . . 0.0 111.697 -175.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . 0.565 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 42.0 t80 -71.52 -40.78 69.88 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 120.722 0.296 . . . . 0.0 110.706 -177.261 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 34.5 p -65.93 -43.73 87.23 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 109.905 -0.405 . . . . 0.0 109.905 177.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . 0.464 ' HG3' ' O ' ' A' ' 115' ' ' ASP . 90.2 mtt180 -55.66 -44.1 76.91 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.135 174.213 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -58.95 -41.98 88.76 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.299 179.188 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 83.6 mt -70.88 -14.86 62.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.811 0.338 . . . . 0.0 111.113 179.134 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . 0.635 ' HE3' ' HA ' ' A' ' 122' ' ' LYS . 0.0 OUTLIER -113.88 7.48 17.0 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.601 179.326 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 97.0 p -84.42 148.95 26.31 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 120.624 0.25 . . . . 0.0 111.041 -179.412 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -60.15 -29.92 68.97 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 174.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 42.0 mm -55.12 -57.09 8.06 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-N 115.261 -0.881 . . . . 0.0 111.167 178.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' TYR . . . . . 0.454 ' O ' ' HG2' ' A' ' 130' ' ' MET . 31.7 t80 -66.22 -38.75 88.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.909 0.385 . . . . 0.0 110.324 -178.236 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 92.1 mt -65.27 -28.57 69.43 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.599 178.512 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -71.9 -37.56 70.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.001 178.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 81.0 mt -64.6 -31.84 73.23 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.964 176.352 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' MET . . . . . 0.648 ' SD ' HG13 ' A' ' 9' ' ' VAL . 26.2 mmt -70.15 -52.88 20.04 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.769 176.846 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 60.56 23.22 12.94 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.762 -179.06 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . -69.75 -21.38 76.48 Favored Glycine 0 C--N 1.33 0.249 0 C-N-CA 120.972 -0.632 . . . . 0.0 111.991 179.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 8.2 ttp180 -171.67 106.21 0.37 Allowed Pre-proline 0 C--N 1.33 -0.282 0 C-N-CA 122.754 0.421 . . . . 0.0 109.91 179.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo . . . . . 0 C--N 1.349 0.598 0 C-N-CA 122.838 2.359 . . . . 0.0 112.039 179.136 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.472 ' HB3' ' HB3' ' A' ' 23' ' ' ASP . 44.0 m . . . . . 0 N--CA 1.476 0.843 0 CA-C-O 121.225 0.536 . . . . 0.0 110.456 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 49.5 ttm -136.74 123.36 21.02 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.711 178.014 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . 0.461 HG12 HD22 ' A' ' 129' ' ' LEU . 14.7 p -77.79 152.86 5.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.901 -174.045 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 29.5 m -95.58 149.24 35.82 Favored Pre-proline 0 CA--C 1.535 0.372 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.434 173.155 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -44.21 -46.39 11.47 Favored 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 123.623 2.882 . . . . 0.0 113.793 -173.056 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.601 ' O ' HG21 ' A' ' 9' ' ' VAL . 33.9 tt0 -61.78 -47.7 83.96 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 120.696 0.284 . . . . 0.0 111.178 -175.8 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -64.35 -34.96 79.35 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.109 0.48 . . . . 0.0 109.889 178.235 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.61 -38.29 89.64 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.235 -179.605 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.601 HG21 ' O ' ' A' ' 6' ' ' GLU . 11.4 m -75.15 -25.89 18.55 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 C-N-CA 120.92 -0.312 . . . . 0.0 110.63 179.833 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.548 ' HG2' ' O ' ' A' ' 6' ' ' GLU . 74.8 mmtt -60.35 -34.48 73.9 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.008 0.432 . . . . 0.0 110.268 176.86 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . 0.411 ' CE3' HD13 ' A' ' 18' ' ' LEU . 49.1 m0 -61.72 -22.37 65.31 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.802 179.451 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -64.61 -13.03 54.73 Favored Glycine 0 CA--C 1.519 0.31 0 CA-C-N 115.848 -0.614 . . . . 0.0 113.072 -178.098 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.53 ' HG2' ' O ' ' A' ' 10' ' ' LYS . 10.7 pt-20 -79.89 -23.19 42.01 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 117.029 0.415 . . . . 0.0 110.739 179.78 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 31.6 t -171.0 132.01 0.83 Allowed 'General case' 0 C--O 1.238 0.469 0 CA-C-O 121.377 0.608 . . . . 0.0 111.716 -177.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 28.6 t80 -60.86 -29.04 69.29 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.861 174.385 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -55.85 -43.79 77.39 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.508 175.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 33.3 ttmt -66.96 -40.49 87.5 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.479 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.411 HD13 ' CE3' ' A' ' 11' ' ' TRP . 39.1 tp -59.23 -40.5 86.1 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.149 0.499 . . . . 0.0 110.311 175.514 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 39.6 tp -73.86 -36.67 64.86 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.341 -176.429 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 24.6 p -79.56 -23.26 42.92 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.583 -177.017 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.71 114.45 13.15 Favored 'General case' 0 C--O 1.223 -0.304 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 177.193 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.419 ' HD2' ' H ' ' A' ' 22' ' ' ARG . 4.2 mpt_? -56.18 -42.32 76.89 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 120.902 0.382 . . . . 0.0 111.167 -170.709 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.472 ' HB3' ' HB3' ' A' ' 1' ' ' SER . 4.1 p-10 -70.18 -33.05 71.27 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.693 176.365 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -64.72 -54.19 30.13 Favored Glycine 0 C--N 1.332 0.357 0 N-CA-C 111.397 -0.681 . . . . 0.0 111.397 177.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.9 tt -54.63 -40.0 68.53 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 123.085 0.554 . . . . 0.0 110.308 174.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.401 ' O ' ' HG3' ' A' ' 30' ' ' ARG . 36.3 tt0 -60.87 -42.83 98.68 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-O 121.059 0.456 . . . . 0.0 110.305 177.73 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -68.87 -36.88 78.62 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.202 0.525 . . . . 0.0 110.516 178.158 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 77.3 t80 -70.32 -43.22 70.75 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.712 -175.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.588 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 7.2 t -64.85 -44.04 91.05 Favored 'General case' 0 C--N 1.333 -0.137 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 178.658 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.401 ' HG3' ' O ' ' A' ' 26' ' ' GLU . 87.7 mtm180 -57.85 -27.76 63.51 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-O 121.047 0.451 . . . . 0.0 110.651 178.816 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.497 ' O ' HG22 ' A' ' 34' ' ' THR . 75.9 t80 -83.32 -41.17 18.55 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.779 175.036 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 17.5 tp -76.62 -21.26 55.77 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.744 -171.483 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.588 ' HG3' ' O ' ' A' ' 29' ' ' THR . 68.5 mttm -61.68 -30.51 70.78 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.343 -178.855 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.497 HG22 ' O ' ' A' ' 31' ' ' PHE . 9.6 t -65.37 -31.0 71.89 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.077 -175.601 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -102.3 8.05 40.46 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 120.916 0.388 . . . . 0.0 110.79 179.41 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 88.9 m-85 59.79 20.05 8.87 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.897 174.435 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 33.0 t -85.59 1.06 50.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.197 0.522 . . . . 0.0 110.348 -177.429 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.412 ' CD ' ' HZ2' ' A' ' 33' ' ' LYS . 52.1 tt0 -58.91 -30.85 68.12 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.283 -179.595 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.478 ' CD ' ' HZ3' ' A' ' 77' ' ' LYS . 10.7 pt-20 -60.74 -24.16 65.49 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.136 179.772 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.511 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 93.6 m-20 -68.21 -39.96 82.25 Favored 'General case' 0 C--O 1.238 0.459 0 CA-C-O 121.405 0.621 . . . . 0.0 109.424 174.689 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 46.0 mt -63.47 -49.73 81.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.422 173.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.433 ' HA ' ' HB ' ' A' ' 45' ' ' ILE . 49.9 mt-10 -60.85 -27.21 67.93 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.891 178.273 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.511 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 62.5 t80 -58.67 -62.61 1.73 Allowed 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.302 176.694 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.521 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 16.0 p-90 -74.91 -14.61 60.67 Favored 'General case' 0 CA--C 1.528 0.1 0 C-N-CA 119.66 -0.816 . . . . 0.0 111.442 -177.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.433 ' HB ' ' HA ' ' A' ' 42' ' ' GLU . 15.6 mt -61.9 -47.11 94.74 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 167.797 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.83 -30.15 70.27 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.275 177.074 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 25.6 t -62.71 -46.28 88.84 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.455 175.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.521 ' HG2' ' O ' ' A' ' 44' ' ' TRP . 26.7 mm-40 -64.35 -35.09 79.75 Favored 'General case' 0 C--N 1.333 -0.134 0 N-CA-C 110.133 -0.321 . . . . 0.0 110.133 178.534 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -57.61 -47.54 81.88 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 173.234 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.409 ' CZ ' HG23 ' A' ' 59' ' ' ILE . 57.8 t80 -59.73 -39.05 83.43 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.457 177.04 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.456 ' HZ2' ' CD ' ' A' ' 48' ' ' GLU . 53.3 mtpt -72.82 -26.61 61.56 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.807 -177.819 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.463 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 65.1 pttt -105.04 -1.89 25.09 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 111.614 0.227 . . . . 0.0 111.614 -178.329 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 35.6 p -79.37 135.48 36.72 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 110.308 -0.256 . . . . 0.0 110.308 177.531 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.68 154.75 20.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.975 0.417 . . . . 0.0 110.499 -179.828 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 99.58 110.83 3.17 Favored Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 111.115 -0.794 . . . . 0.0 111.115 -176.31 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -51.55 -38.88 65.58 Favored 'Trans proline' 0 C--N 1.352 0.736 0 C-N-CA 122.9 2.4 . . . . 0.0 111.851 -177.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 -54.54 -49.89 69.23 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.119 178.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 8.5 tp-100 -58.16 -43.49 87.43 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.15 -0.932 . . . . 0.0 110.016 -179.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.409 HG23 ' CZ ' ' A' ' 50' ' ' PHE . 46.7 mm -60.88 -46.82 95.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.505 -178.79 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.432 ' O ' ' HG2' ' A' ' 64' ' ' LYS . 12.3 m170 -62.7 -48.14 80.57 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.358 -174.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.577 HD12 ' N ' ' A' ' 62' ' ' LYS . 3.6 pp -72.48 -38.05 68.28 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.47 -176.644 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.577 ' N ' HD12 ' A' ' 61' ' ' LEU . 28.7 mmtp -64.76 -38.68 91.79 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.786 0.327 . . . . 0.0 110.566 177.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.04 -47.61 77.55 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.499 177.014 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.432 ' HG2' ' O ' ' A' ' 60' ' ' HIS . 48.3 mmtm -62.62 -40.79 98.06 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.898 -179.429 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.83 -55.61 28.06 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.355 -178.404 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 68.0 mt -60.99 -35.99 69.09 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 CA-C-O 121.296 0.57 . . . . 0.0 110.244 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.498 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 79.7 t80 -59.2 -67.99 0.32 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.152 -179.432 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -61.51 -31.52 71.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.254 -0.43 . . . . 0.0 112.013 -173.558 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.417 ' HE3' ' CE2' ' A' ' 70' ' ' PHE . 36.4 ttpt -83.03 -32.26 26.98 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.225 0.454 . . . . 0.0 112.225 -172.699 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . 0.417 ' CE2' ' HE3' ' A' ' 69' ' ' LYS . 51.2 m-85 -131.98 -46.87 0.94 Allowed 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 112.894 0.702 . . . . 0.0 112.894 -174.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.498 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 47.7 mm -68.95 -37.14 76.9 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 CA-C-O 120.749 0.309 . . . . 0.0 111.581 -173.215 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.696 ' HG3' ' H ' ' A' ' 74' ' ' ASP . 6.4 tp-100 -57.98 138.29 56.03 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.868 -176.513 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 15.3 m -79.92 9.3 5.5 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.747 0.784 . . . . 0.0 110.708 -179.202 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.696 ' H ' ' HG3' ' A' ' 72' ' ' GLN . 22.0 m-20 -132.9 25.23 4.3 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.245 -0.888 . . . . 0.0 108.744 172.204 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.78 156.02 92.57 Favored Pre-proline 0 CA--C 1.531 0.225 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.031 -178.2 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -62.17 -23.93 75.87 Favored 'Trans proline' 0 C--N 1.35 0.619 0 C-N-CA 122.702 2.268 . . . . 0.0 112.762 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.478 ' HZ3' ' CD ' ' A' ' 39' ' ' GLU . 30.9 mmtp -115.57 -56.84 2.3 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.312 179.167 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 65.8 114.77 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.372 0 O-C-N 123.671 0.607 . . . . 0.0 110.983 -173.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.431 HG13 ' O ' ' A' ' 79' ' ' VAL . 10.6 t -91.88 25.6 0.39 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 CA-C-O 121.118 0.485 . . . . 0.0 110.101 179.187 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 9.5 p30 43.01 27.97 0.12 Allowed 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.821 0.848 . . . . 0.0 112.388 179.277 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.458 HD11 HG22 ' A' ' 85' ' ' THR . 24.5 tp -56.79 145.45 29.3 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.635 -0.712 . . . . 0.0 111.94 -178.47 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -48.03 138.9 8.63 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.135 -0.939 . . . . 0.0 111.808 179.467 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.523 ' HA ' ' HD2' ' A' ' 86' ' ' LYS . 64.5 t80 -64.22 -41.52 96.98 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.826 -174.714 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 85.1 t60 -70.19 -29.5 66.38 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.863 0.363 . . . . 0.0 110.46 -178.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.458 HG22 HD11 ' A' ' 81' ' ' LEU . 25.9 m -69.17 -41.12 77.64 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 175.06 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.523 ' HD2' ' HA ' ' A' ' 83' ' ' PHE . 47.4 mttm -54.77 -46.77 74.45 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.504 171.888 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -52.19 -55.38 21.47 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 114.938 -1.028 . . . . 0.0 110.966 -179.001 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 61.9 t -55.06 -43.19 68.69 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 CA-C-O 121.176 0.513 . . . . 0.0 110.601 -179.317 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 74.3 mt -66.63 -41.63 88.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.949 -178.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 68.7 p -66.86 -18.89 65.6 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.0 0.428 . . . . 0.0 110.955 -179.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 79.8 m-20 -86.97 -31.6 20.53 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.046 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 22.3 p -107.17 -4.61 18.63 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -175.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 8.0 tp -54.3 -28.11 17.89 Favored 'Isoleucine or valine' 0 C--O 1.238 0.493 0 N-CA-C 112.003 0.372 . . . . 0.0 112.003 -174.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.476 HG22 ' HG2' ' A' ' 95' ' ' GLN . 3.4 t -55.1 -48.84 73.03 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.752 177.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.476 ' HG2' HG22 ' A' ' 94' ' ' THR . 21.8 pt20 -162.19 82.02 1.76 Allowed Pre-proline 0 CA--C 1.532 0.261 0 CA-C-O 121.282 0.563 . . . . 0.0 109.871 -177.84 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -85.26 167.23 10.68 Favored 'Trans proline' 0 CA--C 1.531 0.374 0 C-N-CA 123.012 2.475 . . . . 0.0 113.227 -174.332 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 2.9 m -86.34 169.43 12.95 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.109 179.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -50.49 -49.41 55.51 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 122.883 0.473 . . . . 0.0 111.852 -176.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . 0.428 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 19.1 m-70 -100.82 33.02 2.93 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 120.86 0.362 . . . . 0.0 111.322 -175.813 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 25.2 p -64.74 -50.27 67.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.946 0.403 . . . . 0.0 110.946 179.053 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -78.59 6.15 9.37 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.528 -179.531 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -58.61 -36.67 74.41 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.163 0.506 . . . . 0.0 110.231 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.9 -44.35 91.21 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.454 174.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.58 -39.3 90.68 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.464 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.491 ' HG2' ' HB2' ' A' ' 44' ' ' TRP . 0.9 OUTLIER -57.48 -52.1 66.76 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 115.958 -0.564 . . . . 0.0 109.751 176.185 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 25.2 t -61.44 -38.3 86.7 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.847 -178.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . 0.559 ' O ' ' HG ' ' A' ' 111' ' ' LEU . 36.7 mmt180 -65.51 -57.1 9.06 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.441 -179.334 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.439 ' HA ' HD11 ' A' ' 111' ' ' LEU . 93.3 t -59.95 -40.58 83.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.892 0.377 . . . . 0.0 110.858 -177.856 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . 0.442 ' HA ' ' HE3' ' A' ' 112' ' ' MET . 3.6 t80 -56.0 -49.61 73.16 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.198 177.591 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.502 ' HG2' ' O ' ' A' ' 107' ' ' ARG . 10.5 pt20 -72.51 -17.73 61.72 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.653 -0.249 . . . . 0.0 111.015 -176.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.559 ' HG ' ' O ' ' A' ' 107' ' ' ARG . 73.3 mt -68.39 -58.65 4.04 Favored 'General case' 0 C--O 1.235 0.312 0 O-C-N 123.189 0.305 . . . . 0.0 110.853 178.609 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' MET . . . . . 0.442 ' HE3' ' HA ' ' A' ' 109' ' ' TYR . 0.1 OUTLIER -75.92 -14.41 60.26 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 120.132 -0.627 . . . . 0.0 110.342 -179.002 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . 0.58 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 39.3 tt0 -60.91 -61.35 2.64 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.145 0.498 . . . . 0.0 109.761 172.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -69.51 5.15 1.47 Allowed 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.816 -0.629 . . . . 0.0 112.595 -173.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -129.4 -66.27 0.82 Allowed 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 120.897 0.379 . . . . 0.0 111.302 176.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 7.4 m -72.64 -28.12 62.55 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.951 -172.276 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . 0.58 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 34.1 t80 -64.89 -46.97 79.51 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 121.219 -0.192 . . . . 0.0 110.691 -179.081 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 31.7 p -64.13 -43.34 95.58 Favored 'General case' 0 C--O 1.239 0.531 0 CA-C-O 121.131 0.491 . . . . 0.0 110.294 179.327 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 51.8 mtt180 -57.33 -42.85 82.71 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.124 175.283 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.403 ' O ' ' HB2' ' A' ' 126' ' ' TYR . 78.4 t80 -61.53 -42.7 99.21 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.385 179.369 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 90.1 mt -60.04 -32.76 71.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.587 -0.279 . . . . 0.0 111.612 -178.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . 0.718 ' HE2' ' HA ' ' A' ' 122' ' ' LYS . 10.0 mmpt? -110.73 11.49 22.62 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 111.998 0.37 . . . . 0.0 111.998 -179.331 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 79.4 p -74.48 156.55 36.8 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-O 120.797 0.332 . . . . 0.0 110.718 177.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -55.63 -30.29 60.71 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.152 175.319 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.454 ' N ' HD12 ' A' ' 125' ' ' ILE . 2.3 mp -63.09 -49.77 82.06 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.218 -178.978 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' TYR . . . . . 0.403 ' HB2' ' O ' ' A' ' 120' ' ' PHE . 71.0 t80 -65.63 -35.41 80.72 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.777 -177.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 88.7 mt -66.36 -34.84 78.88 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.914 0.388 . . . . 0.0 109.956 176.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -68.86 -33.26 73.51 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.844 -0.616 . . . . 0.0 109.79 175.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.461 HD22 HG12 ' A' ' 3' ' ' VAL . 88.6 mt -74.04 -32.66 63.43 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.386 176.104 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' MET . . . . . 0.709 ' HA ' ' HE3' ' A' ' 130' ' ' MET . 7.5 mmt -57.0 -55.76 30.47 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.687 176.5 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 69.36 -65.23 0.31 Allowed 'General case' 0 N--CA 1.465 0.325 0 O-C-N 124.08 0.862 . . . . 0.0 111.434 176.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . -72.5 -44.79 39.85 Favored Glycine 0 N--CA 1.45 -0.403 0 CA-C-N 115.996 -0.547 . . . . 0.0 113.127 -172.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . 0.491 ' O ' ' HG3' ' A' ' 133' ' ' ARG . 34.0 ptt180 -113.77 98.31 47.03 Favored Pre-proline 0 CA--C 1.538 0.486 0 CA-C-O 121.201 0.524 . . . . 0.0 111.389 -177.182 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo . . . . . 0 N--CA 1.459 -0.523 0 C-N-CA 122.753 2.302 . . . . 0.0 110.936 171.703 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 37.4 t . . . . . 0 N--CA 1.48 1.037 0 N-CA-C 110.225 -0.287 . . . . 0.0 110.225 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 53.3 ttm 57.18 84.95 0.09 Allowed 'General case' 0 C--O 1.236 0.354 0 O-C-N 123.664 0.603 . . . . 0.0 111.132 178.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 2.6 p -66.96 132.07 32.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.459 176.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.6 m -61.74 141.66 94.99 Favored Pre-proline 0 CA--C 1.534 0.339 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.248 178.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -55.22 -35.39 90.99 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 122.564 2.176 . . . . 0.0 111.845 -179.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -65.48 -49.36 69.37 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 178.009 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -55.65 -44.32 77.09 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.112 176.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.34 -57.03 14.81 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.255 -178.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 26.5 m -64.03 -26.06 39.6 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 CA-C-O 120.826 0.346 . . . . 0.0 110.682 -179.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 16.3 tppt? -68.86 -30.16 68.62 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.499 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . 0.452 ' HZ2' ' ND1' ' A' ' 21' ' ' HIS . 54.5 m0 -62.1 -31.52 71.98 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 121.058 0.456 . . . . 0.0 109.926 174.529 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -59.79 -16.44 38.54 Favored Glycine 0 C--N 1.335 0.508 0 CA-C-N 115.787 -0.642 . . . . 0.0 113.518 -175.056 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -116.77 3.86 12.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.624 0.249 . . . . 0.0 110.987 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 43.9 m -152.02 98.01 2.39 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 120.871 0.367 . . . . 0.0 111.136 -178.3 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 57.1 t80 -65.2 -36.0 82.82 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 121.313 0.578 . . . . 0.0 109.554 178.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -58.93 -32.84 69.93 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.278 -0.873 . . . . 0.0 110.325 177.347 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 22.9 ttmm -72.98 -39.17 66.31 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.0 -0.545 . . . . 0.0 109.86 -179.61 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.481 HD23 ' CE1' ' A' ' 117' ' ' TYR . 14.9 tp -56.18 -50.48 71.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.983 174.499 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 34.4 tp -70.55 -31.57 68.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.133 -0.939 . . . . 0.0 111.524 -175.22 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 38.6 p -81.4 -25.77 35.97 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 120.693 0.282 . . . . 0.0 111.113 -179.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . 0.452 ' ND1' ' HZ2' ' A' ' 11' ' ' TRP . 23.8 t-80 -85.29 118.0 24.57 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 179.492 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 39.5 mtm180 -42.24 -54.88 3.52 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.08 0.552 . . . . 0.0 111.751 -177.193 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -57.14 -36.36 70.61 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.265 -179.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -71.98 -51.31 14.97 Favored Glycine 0 N--CA 1.451 -0.302 0 N-CA-C 111.674 -0.57 . . . . 0.0 111.674 -178.468 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 7.0 tt -54.03 -48.16 70.79 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.247 -0.476 . . . . 0.0 110.277 176.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -61.31 -51.23 69.73 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.632 -179.315 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -60.58 -41.62 95.01 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.326 -177.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 77.6 t80 -74.9 -42.17 58.33 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.178 -175.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.449 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 10.6 t -64.66 -43.5 93.42 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 120.966 -0.293 . . . . 0.0 110.418 -176.771 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.46 -33.04 74.32 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 121.073 0.463 . . . . 0.0 110.006 179.315 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.433 ' O ' HG21 ' A' ' 34' ' ' THR . 92.4 t80 -65.95 -48.99 69.51 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.499 178.686 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 19.5 tp -68.77 -26.16 65.08 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.102 0.477 . . . . 0.0 110.882 -175.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.506 ' HG2' ' HB3' ' A' ' 38' ' ' GLU . 68.4 mttm -85.26 -1.17 56.65 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.611 -179.419 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.433 HG21 ' O ' ' A' ' 31' ' ' PHE . 3.8 t -69.79 -33.34 72.25 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 120.937 0.398 . . . . 0.0 110.339 179.755 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -118.79 16.73 13.54 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.356 178.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 83.5 m-85 60.15 28.89 18.5 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 115.418 -0.81 . . . . 0.0 112.009 176.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 21.8 t -82.27 4.71 22.57 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 121.884 0.849 . . . . 0.0 108.779 174.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.506 ' HB3' ' HG2' ' A' ' 33' ' ' LYS . 13.7 pt-20 -56.42 -19.31 14.38 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 114.577 -1.192 . . . . 0.0 111.629 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.419 ' O ' ' HB2' ' A' ' 43' ' ' PHE . 10.1 mm-40 -45.77 -33.07 2.84 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.083 179.384 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.5 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 49.7 m-80 -72.63 -47.49 47.23 Favored 'General case' 0 C--O 1.24 0.581 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.552 -178.434 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.444 ' HA ' ' HE2' ' A' ' 112' ' ' MET . 13.6 tt -70.94 -45.41 73.15 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 -177.257 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.471 ' OE1' ' HB2' ' A' ' 38' ' ' GLU . 4.2 mp0 -63.26 -23.27 67.35 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.65 174.318 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.5 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 66.8 t80 -62.09 -60.85 3.0 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 120.471 0.176 . . . . 0.0 110.776 177.632 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.593 ' HB2' ' HG3' ' A' ' 105' ' ' GLN . 13.1 p-90 -72.92 -9.68 58.97 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 119.258 -0.977 . . . . 0.0 111.513 -177.58 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.415 HG13 ' O ' ' A' ' 41' ' ' ILE . 79.8 mt -79.82 -33.22 14.64 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 166.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.461 ' HA ' ' OD2' ' A' ' 49' ' ' ASP . . . -67.14 -21.62 65.81 Favored 'General case' 0 CA--C 1.522 -0.105 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.64 179.071 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 44.4 t -68.72 -32.82 72.89 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.731 172.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.503 ' O ' ' HG2' ' A' ' 51' ' ' LYS . 17.0 mm-40 -75.17 -49.25 20.06 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.316 179.646 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.483 ' HA ' ' HD3' ' A' ' 52' ' ' LYS . 3.1 p30 -70.32 -11.99 61.28 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.465 177.426 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 24.5 t80 -71.76 -49.2 41.09 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.371 174.201 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.503 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 13.1 ptmm? -62.38 -26.08 68.27 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.891 0.376 . . . . 0.0 109.998 176.855 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.483 ' HD3' ' HA ' ' A' ' 49' ' ' ASP . 51.1 mtpt -67.34 -31.44 71.7 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.674 175.22 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 31.6 m -82.32 51.26 1.77 Allowed 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 121.243 0.544 . . . . 0.0 109.81 178.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.77 16.83 0.08 Allowed 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 114.052 1.131 . . . . 0.0 114.052 -170.186 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . 0.475 ' O ' HG12 ' A' ' 59' ' ' ILE . . . -65.88 130.64 33.5 Favored Glycine 0 CA--C 1.523 0.569 0 C-N-CA 120.555 -0.831 . . . . 0.0 111.211 175.504 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -50.46 -43.93 42.09 Favored 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 123.058 2.505 . . . . 0.0 113.009 -173.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 22.0 tm0? -93.83 -33.15 13.66 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 179.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 25.5 tp60 -54.11 -35.6 62.33 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.958 179.391 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.475 HG12 ' O ' ' A' ' 55' ' ' GLY . 27.1 mm -52.77 -42.25 41.5 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.611 176.201 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 22.8 m-70 -65.63 -45.18 84.04 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.52 -177.466 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 91.0 mt -68.03 -43.65 78.28 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.011 -178.504 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.47 ' NZ ' HD13 ' A' ' 66' ' ' ILE . 8.0 tmtt? -66.35 -40.96 90.13 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.512 -177.105 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.9 -41.3 87.39 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.543 176.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 14.6 tppt? -53.69 -46.99 70.88 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.723 177.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.7 -59.68 4.66 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.579 179.235 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.47 HD13 ' NZ ' ' A' ' 62' ' ' LYS . 66.5 mt -56.73 -35.59 46.28 Favored 'Isoleucine or valine' 0 C--O 1.235 0.336 0 CA-C-O 121.37 0.605 . . . . 0.0 110.522 179.545 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.426 ' OH ' HG23 ' A' ' 90' ' ' THR . 83.1 t80 -62.8 -67.68 0.4 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.171 -176.803 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.479 ' HA ' ' HB2' ' A' ' 72' ' ' GLN . 29.1 mt-10 -77.43 -1.81 32.1 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 -172.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 65.8 tttp -100.57 -28.73 12.73 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 116.865 -0.152 . . . . 0.0 111.334 177.486 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . 0.426 ' HB3' HG23 ' A' ' 79' ' ' VAL . 75.0 m-85 -132.86 -43.98 0.88 Allowed 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -175.657 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 45.5 mm -77.0 -36.59 25.2 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 CA-C-O 120.698 0.285 . . . . 0.0 111.691 -173.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.479 ' HB2' ' HA ' ' A' ' 68' ' ' GLU . 60.0 tp60 -59.25 133.66 56.3 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.829 -175.194 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 37.1 p -61.95 124.06 19.74 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.017 177.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 26.9 t70 70.99 29.9 2.88 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.117 -178.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.414 ' HB1' ' HD2' ' A' ' 76' ' ' PRO . . . -63.65 164.91 13.71 Favored Pre-proline 0 CA--C 1.537 0.445 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.724 171.682 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.414 ' HD2' ' HB1' ' A' ' 75' ' ' ALA . 84.7 Cg_exo -45.18 -57.61 2.02 Favored 'Trans proline' 0 C--N 1.356 0.955 0 C-N-CA 122.499 2.133 . . . . 0.0 111.915 178.834 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.1 72.66 1.47 Allowed 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 171.736 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -68.05 146.76 53.2 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.184 -178.289 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.453 HG13 HG22 ' A' ' 108' ' ' VAL . 53.5 t -85.02 147.05 5.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 176.982 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 46.7 m-80 -77.86 51.8 0.98 Allowed 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 121.606 0.717 . . . . 0.0 110.151 177.723 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 44.8 tp -73.79 147.22 43.62 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.001 -0.999 . . . . 0.0 110.351 178.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -50.34 139.98 14.24 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.431 178.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 47.8 p90 -64.79 -37.35 87.33 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.945 -176.26 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . 0.414 ' O ' ' HB3' ' A' ' 87' ' ' GLU . 72.4 t60 -69.16 -36.61 77.59 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.81 0.338 . . . . 0.0 110.379 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 38.7 m -66.86 -43.99 82.14 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.121 176.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.434 ' O ' HG22 ' A' ' 90' ' ' THR . 95.7 mttt -60.82 -38.56 85.85 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 174.831 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.414 ' HB3' ' O ' ' A' ' 84' ' ' HIS . 43.2 tt0 -56.52 -50.19 72.56 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.41 177.719 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.402 HG21 ' O ' ' A' ' 84' ' ' HIS . 96.2 t -62.42 -51.15 75.85 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.797 179.079 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 71.4 mt -57.73 -49.29 81.29 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.273 -176.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.434 HG22 ' O ' ' A' ' 86' ' ' LYS . 49.1 p -57.66 -39.98 78.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.166 0.507 . . . . 0.0 111.083 -178.473 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 32.9 m-80 -85.61 -4.87 59.28 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.983 -176.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 15.3 m -124.88 0.84 8.04 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.7 tp -66.63 -23.01 30.6 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 CA-C-O 120.761 0.315 . . . . 0.0 111.459 -174.006 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.515 HG22 ' HG2' ' A' ' 95' ' ' GLN . 15.4 t -63.03 -25.31 68.32 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.981 179.298 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.515 ' HG2' HG22 ' A' ' 94' ' ' THR . 11.4 pt20 -151.83 77.25 7.11 Favored Pre-proline 0 CA--C 1.536 0.412 0 CA-C-O 121.236 0.541 . . . . 0.0 110.503 179.596 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . 0.463 ' HG2' HG22 ' A' ' 59' ' ' ILE . 96.4 Cg_endo -88.69 159.31 6.32 Favored 'Trans proline' 0 N--CA 1.461 -0.418 0 C-N-CA 122.768 2.312 . . . . 0.0 112.214 179.134 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' THR . . . . . 0.413 ' H ' ' HB2' ' A' ' 100' ' ' SER . 18.5 p -96.3 172.28 8.05 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.938 176.355 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 10.4 mp -53.29 -30.32 38.07 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 -174.029 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -133.2 31.71 3.79 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.907 0.384 . . . . 0.0 110.513 -176.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' SER . . . . . 0.413 ' HB2' ' H ' ' A' ' 97' ' ' THR . 23.5 t -54.68 -26.02 30.8 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.82 -177.321 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -83.68 17.9 2.11 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.438 -178.703 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -56.94 -50.13 73.53 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.917 0.389 . . . . 0.0 110.965 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.7 -47.97 83.53 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.671 179.074 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.402 ' O ' HG21 ' A' ' 108' ' ' VAL . . . -60.52 -36.81 79.29 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.532 178.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.593 ' HG3' ' HB2' ' A' ' 44' ' ' TRP . 57.3 tt0 -57.29 -44.16 83.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.185 -179.246 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 14.4 m -69.36 -41.72 76.2 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.762 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . 0.476 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 38.4 mmt180 -60.03 -43.94 94.98 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.365 -178.119 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.453 HG22 HG13 ' A' ' 79' ' ' VAL . 83.4 t -69.22 -43.4 81.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.95 0.405 . . . . 0.0 111.068 -177.655 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 25.0 t80 -56.8 -46.22 81.73 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.376 179.293 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.476 ' HG3' ' O ' ' A' ' 107' ' ' ARG . 5.3 pp0? -70.11 -36.46 74.86 Favored 'General case' 0 C--O 1.238 0.485 0 N-CA-C 111.677 0.251 . . . . 0.0 111.677 -175.819 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.488 ' HA ' ' HG2' ' A' ' 114' ' ' GLN . 4.5 pp -74.0 -28.05 61.26 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 120.815 -0.354 . . . . 0.0 110.269 179.415 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' MET . . . . . 0.444 ' HE2' ' HA ' ' A' ' 41' ' ' ILE . 44.2 ttm -61.89 -39.63 92.61 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.563 175.162 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . 0.439 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 3.2 tm-20 -59.79 -60.88 3.13 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.624 -0.717 . . . . 0.0 110.164 177.56 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . 0.488 ' HG2' ' HA ' ' A' ' 111' ' ' LEU . 13.7 pt20 -64.63 -18.13 64.65 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -173.072 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -110.28 -67.27 1.0 Allowed 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.138 0.494 . . . . 0.0 111.71 -179.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 17.4 m -72.5 -31.45 65.37 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.696 -172.589 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . 0.481 ' CE1' HD23 ' A' ' 18' ' ' LEU . 18.3 t80 -81.72 -36.91 28.09 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.175 -0.61 . . . . 0.0 110.924 -177.602 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 22.0 p -60.04 -47.49 85.65 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-O 120.905 0.384 . . . . 0.0 110.45 178.353 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 14.7 ptp180 -61.49 -36.07 79.44 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 176.025 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -65.56 -33.84 76.85 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.557 177.343 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 86.3 mt -65.15 -28.69 69.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.028 0.442 . . . . 0.0 110.196 176.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 3.7 tppp? -93.44 -9.86 37.08 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.379 179.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 60.7 p -59.85 146.84 40.52 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-O 121.153 0.501 . . . . 0.0 111.578 -176.301 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -59.73 -38.03 80.56 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.173 179.31 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.446 ' O ' ' HG ' ' A' ' 129' ' ' LEU . 0.0 OUTLIER -64.49 -47.04 90.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.66 -176.922 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -66.38 -48.35 70.4 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 120.877 0.37 . . . . 0.0 111.132 -177.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 95.5 mt -63.37 -29.59 70.87 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.871 -179.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -67.79 -39.23 84.04 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.668 177.079 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 125' ' ' ILE . 97.8 mt -61.15 -47.86 84.24 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.988 -179.103 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' MET . . . . . 0.4 ' HG3' ' N ' ' A' ' 131' ' ' GLU . 14.8 ptp -76.06 -41.02 51.97 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.249 -178.846 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . 0.4 ' N ' ' HG3' ' A' ' 130' ' ' MET . 38.8 tt0 62.77 -72.21 0.05 OUTLIER 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 123.375 0.67 . . . . 0.0 110.747 -175.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 168.4 -52.94 0.22 Allowed Glycine 0 N--CA 1.449 -0.49 0 N-CA-C 110.899 -0.88 . . . . 0.0 110.899 -178.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -171.85 100.9 0.38 Allowed Pre-proline 0 CA--C 1.535 0.398 0 C-N-CA 122.756 0.423 . . . . 0.0 110.849 177.48 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo . . . . . 0 C--N 1.348 0.542 0 C-N-CA 123.222 2.614 . . . . 0.0 112.43 177.581 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 23.9 t . . . . . 0 N--CA 1.479 0.983 0 CA-C-O 120.804 0.335 . . . . 0.0 110.557 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 23.8 ptm -103.65 118.21 36.2 Favored 'General case' 0 C--O 1.234 0.257 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 175.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 6.8 p -165.49 151.64 2.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.89 0.376 . . . . 0.0 111.56 -176.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 17.3 m -100.17 148.19 34.54 Favored Pre-proline 0 CA--C 1.535 0.383 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.743 175.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo -49.27 -44.22 34.68 Favored 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 123.057 2.505 . . . . 0.0 113.232 -177.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.417 ' HA ' HG21 ' A' ' 9' ' ' VAL . 32.6 mt-10 -70.61 -24.38 62.73 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.222 -177.175 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 21.2 tp10 -73.21 -34.33 65.88 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 173.187 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.757 ' HB1' ' SD ' ' A' ' 130' ' ' MET . . . -66.68 -42.22 86.85 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.048 179.789 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.417 HG21 ' HA ' ' A' ' 6' ' ' GLU . 27.1 m -68.26 -25.69 32.2 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 CA-C-O 120.971 0.415 . . . . 0.0 110.195 175.594 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.463 ' CG ' ' HZ3' ' A' ' 17' ' ' LYS . 16.9 tppt? -69.58 -27.86 65.48 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.007 174.074 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 46.8 m0 -72.15 -35.27 69.02 Favored 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 171.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -69.0 -2.64 32.03 Favored Glycine 0 N--CA 1.452 -0.298 0 CA-C-N 115.15 -0.932 . . . . 0.0 113.568 -176.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -115.42 4.44 14.33 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 117.048 0.424 . . . . 0.0 110.507 176.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.1 p -161.46 92.95 0.91 Allowed 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 121.039 0.447 . . . . 0.0 111.101 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.402 ' CE1' HD21 ' A' ' 18' ' ' LEU . 13.1 t80 -58.27 -38.6 77.28 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.007 177.851 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -48.88 -42.07 35.47 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.389 173.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.463 ' HZ3' ' CG ' ' A' ' 10' ' ' LYS . 87.4 tttt -76.12 -27.37 57.05 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.26 -178.473 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.402 HD21 ' CE1' ' A' ' 15' ' ' PHE . 52.8 tp -59.15 -43.27 92.04 Favored 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 110.054 -0.35 . . . . 0.0 110.054 179.008 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -75.31 -32.02 60.84 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.374 176.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 43.3 t -61.72 -35.3 77.64 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.476 178.093 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -80.56 115.08 19.89 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 177.195 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.31 -44.3 54.05 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 121.254 0.549 . . . . 0.0 110.583 177.084 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -72.39 -28.23 62.86 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.827 -178.507 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -71.01 -44.83 54.2 Favored Glycine 0 N--CA 1.451 -0.324 0 N-CA-C 111.063 -0.815 . . . . 0.0 111.063 177.084 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.3 tt -62.57 -41.46 98.95 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.923 -0.639 . . . . 0.0 110.481 177.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.483 ' O ' ' HG2' ' A' ' 30' ' ' ARG . 43.6 tt0 -58.84 -47.84 83.43 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.876 0.37 . . . . 0.0 110.211 177.473 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -63.61 -40.86 98.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.963 0.411 . . . . 0.0 110.78 179.241 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 73.2 t80 -64.53 -45.4 87.36 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.071 -177.202 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.536 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 9.7 t -66.54 -41.67 88.35 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 120.91 -0.316 . . . . 0.0 110.558 -179.451 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.483 ' HG2' ' O ' ' A' ' 26' ' ' GLU . 12.1 mmt180 -54.1 -36.01 62.76 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 120.994 0.426 . . . . 0.0 110.395 178.651 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.427 ' O ' HG23 ' A' ' 34' ' ' THR . 63.4 t80 -70.62 -53.73 14.76 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.543 175.579 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 28.2 tp -64.07 -24.1 67.58 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.91 -173.181 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.536 ' HG3' ' O ' ' A' ' 29' ' ' THR . 68.5 mttm -65.02 -14.05 59.43 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 116.749 -0.205 . . . . 0.0 111.336 179.58 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.427 HG23 ' O ' ' A' ' 31' ' ' PHE . 14.3 t -62.82 -34.51 77.46 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 120.851 0.358 . . . . 0.0 110.7 179.275 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -115.76 7.94 14.75 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.13 -175.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 92.5 m-85 59.54 17.09 5.79 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 115.942 -0.572 . . . . 0.0 112.542 173.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 8.4 t -86.86 27.57 0.99 Allowed 'General case' 0 C--O 1.235 0.3 0 CA-C-O 121.63 0.729 . . . . 0.0 109.638 -179.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 64.6 tt0 -71.83 -13.62 61.73 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.956 -177.177 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.45 ' HB3' ' HB3' ' A' ' 77' ' ' LYS . 0.8 OUTLIER -55.74 -26.61 46.39 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 111.704 0.261 . . . . 0.0 111.704 -178.354 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 57.3 m-80 -61.65 -50.15 73.68 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-O 121.625 0.726 . . . . 0.0 109.944 173.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 61.7 mt -63.5 -49.72 81.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.935 178.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -57.96 -30.87 66.35 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.805 177.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 79.1 t80 -58.69 -63.23 1.36 Allowed 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.502 179.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.576 ' HA ' ' SG ' ' A' ' 47' ' ' CYS . 6.2 p-90 -79.05 -5.99 55.34 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 119.545 -0.862 . . . . 0.0 112.148 -178.778 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 8.8 mt -69.37 -45.88 77.91 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 166.335 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.45 -32.04 73.49 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.326 177.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.576 ' SG ' ' HA ' ' A' ' 44' ' ' TRP . 73.6 m -64.35 -30.72 71.76 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.801 177.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.426 ' O ' ' HG3' ' A' ' 51' ' ' LYS . 39.8 tt0 -77.0 -40.86 45.14 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 178.011 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -61.44 -31.64 71.59 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 121.525 0.679 . . . . 0.0 109.671 173.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.464 ' CZ ' HG21 ' A' ' 59' ' ' ILE . 56.4 t80 -65.36 -52.67 52.12 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 114.911 -1.04 . . . . 0.0 111.162 178.709 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.426 ' HG3' ' O ' ' A' ' 48' ' ' GLU . 0.0 OUTLIER -68.87 -21.49 64.26 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 121.347 0.594 . . . . 0.0 110.028 179.749 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 8.8 tttm -69.68 -19.71 63.58 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.271 173.363 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 15.5 m -84.29 43.66 0.97 Allowed 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.517 179.041 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.19 98.47 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.678 0.752 . . . . 0.0 112.407 -177.477 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . 0.498 ' O ' HG12 ' A' ' 59' ' ' ILE . . . -179.91 129.15 1.3 Allowed Glycine 0 C--O 1.226 -0.392 0 N-CA-C 110.624 -0.99 . . . . 0.0 110.624 176.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_endo -46.29 -58.23 1.79 Allowed 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.951 2.434 . . . . 0.0 112.997 -172.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -71.16 -38.15 72.19 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 120.978 0.418 . . . . 0.0 110.543 -178.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.575 ' OE1' HD13 ' A' ' 61' ' ' LEU . 5.4 tp-100 -57.46 -42.31 82.32 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.489 -178.357 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.498 HG12 ' O ' ' A' ' 55' ' ' GLY . 36.9 mm -58.46 -47.12 89.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.312 -178.69 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 16.6 m-70 -64.76 -46.04 83.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.277 -174.499 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.575 HD13 ' OE1' ' A' ' 58' ' ' GLN . 4.5 pp -71.59 -33.23 68.86 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.127 -176.928 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.469 ' N ' HD12 ' A' ' 61' ' ' LEU . 12.3 mmmm -68.55 -42.67 78.05 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 110.095 -0.335 . . . . 0.0 110.095 176.061 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.22 -39.48 90.41 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.372 177.305 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.461 ' O ' ' HB3' ' A' ' 67' ' ' TYR . 4.0 tmtp? -65.3 -38.22 89.53 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.898 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -65.36 -49.85 67.78 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.137 0.494 . . . . 0.0 110.303 177.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 70.8 mt -61.66 -30.65 48.74 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.069 177.128 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.515 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 78.2 t80 -58.85 -58.32 9.14 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.494 178.334 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -70.09 -26.65 64.08 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.88 -0.6 . . . . 0.0 112.095 -172.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 35.2 ttpt -99.87 -28.31 13.18 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 -174.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -120.27 -45.27 2.45 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -176.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.515 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 44.2 mm -76.64 -22.6 15.12 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 CA-C-O 120.573 0.225 . . . . 0.0 110.984 -173.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.464 ' HG3' ' H ' ' A' ' 74' ' ' ASP . 6.3 tp60 -50.54 148.18 4.02 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.735 176.601 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 26.1 m -57.48 -42.85 83.47 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.267 -179.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.464 ' H ' ' HG3' ' A' ' 72' ' ' GLN . 6.7 m-20 -82.88 -72.4 0.45 Allowed 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.281 -179.44 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . 69.24 134.71 0.04 OUTLIER Pre-proline 0 CA--C 1.535 0.403 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.761 -177.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -59.33 -35.76 96.05 Favored 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 122.587 2.191 . . . . 0.0 112.044 -178.39 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.45 ' HB3' ' HB3' ' A' ' 39' ' ' GLU . 14.1 mmmm -87.88 -15.61 36.24 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.575 178.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 58.73 83.14 0.13 Allowed 'General case' 0 C--O 1.236 0.387 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.018 -177.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 35.9 t -80.93 140.74 16.18 Favored 'Isoleucine or valine' 0 C--O 1.234 0.275 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.48 -176.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 23.9 m-80 -88.54 11.26 17.7 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.118 -0.492 . . . . 0.0 112.025 -172.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.475 HD12 HG21 ' A' ' 85' ' ' THR . 25.7 tp -59.15 145.0 44.09 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -175.336 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.457 ' O ' ' HG3' ' A' ' 86' ' ' LYS . 10.9 t70 -55.64 145.33 23.92 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 115.044 -0.98 . . . . 0.0 112.543 -177.76 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 45.7 p90 -67.3 -42.46 83.69 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.812 -175.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . 0.481 ' O ' ' HB3' ' A' ' 87' ' ' GLU . 69.4 t60 -69.15 -29.51 67.56 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.898 0.38 . . . . 0.0 110.341 -177.849 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.534 ' OG1' ' HG3' ' A' ' 107' ' ' ARG . 22.1 m -67.15 -45.97 75.48 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 176.589 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.457 ' HG3' ' O ' ' A' ' 82' ' ' ASP . 26.3 mtpp -56.65 -39.08 73.08 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 109.26 -0.645 . . . . 0.0 109.26 175.24 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.481 ' HB3' ' O ' ' A' ' 84' ' ' HIS . 56.1 tt0 -58.18 -53.83 53.89 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.601 177.639 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.431 HG21 ' O ' ' A' ' 84' ' ' HIS . 96.9 t -55.14 -43.2 69.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.071 0.462 . . . . 0.0 110.312 179.446 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.407 HG13 ' O ' ' A' ' 85' ' ' THR . 73.9 mt -65.25 -42.43 93.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.091 -179.394 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 41.1 p -64.38 -18.39 64.63 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 120.93 0.395 . . . . 0.0 111.031 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 47.6 m-80 -88.85 -41.56 12.4 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.564 174.472 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 22.8 t -87.83 0.54 55.66 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.572 -174.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 8.9 tp -57.12 -29.1 31.04 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.383 0 CA-C-O 120.945 0.402 . . . . 0.0 111.143 -179.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 9.0 t -68.27 -33.88 75.17 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.826 179.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 75.5 mm-40 -139.25 80.32 23.49 Favored Pre-proline 0 C--O 1.234 0.276 0 CA-C-O 120.988 0.423 . . . . 0.0 110.955 -178.067 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . 0.489 ' HG2' HG22 ' A' ' 59' ' ' ILE . 89.5 Cg_endo -85.72 133.63 4.42 Favored 'Trans proline' 0 N--CA 1.46 -0.461 0 C-N-CA 122.685 2.257 . . . . 0.0 111.774 174.36 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' THR . . . . . 0.437 ' N ' ' HB2' ' A' ' 100' ' ' SER . 9.5 p -83.22 176.2 9.35 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.71 176.676 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -52.14 -45.98 65.2 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.042 0.448 . . . . 0.0 111.229 -175.108 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 7.7 t-80 -116.78 31.85 6.5 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.754 -176.58 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' SER . . . . . 0.437 ' HB2' ' N ' ' A' ' 97' ' ' THR . 20.8 t -45.87 -40.09 9.51 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.633 -0.712 . . . . 0.0 112.683 -172.797 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 -76.04 16.5 0.42 Allowed 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 112.001 0.371 . . . . 0.0 112.001 -177.131 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -58.47 -46.99 85.48 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 121.08 0.466 . . . . 0.0 110.786 178.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.78 -42.89 90.06 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.403 178.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.0 -36.71 85.28 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.649 179.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -57.56 -51.44 69.48 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.419 177.327 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' SER . . . . . 0.632 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 31.4 t -57.3 -48.55 78.64 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.211 179.655 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . 0.534 ' HG3' ' OG1' ' A' ' 85' ' ' THR . 24.9 mmt180 -53.42 -54.85 30.93 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.317 -179.337 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.502 ' HA ' HD11 ' A' ' 111' ' ' LEU . 98.7 t -60.16 -40.21 82.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.563 -179.604 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . 0.586 ' HA ' ' SD ' ' A' ' 112' ' ' MET . 28.5 t80 -57.25 -41.21 79.18 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.147 178.718 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.632 ' HG3' ' O ' ' A' ' 106' ' ' SER . 48.9 mt-30 -63.46 -39.94 95.81 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 121.55 0.69 . . . . 0.0 109.816 178.659 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.526 ' HG ' ' O ' ' A' ' 107' ' ' ARG . 93.9 mt -59.33 -49.11 79.09 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 114.581 -1.191 . . . . 0.0 111.934 -173.16 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' MET . . . . . 0.586 ' SD ' ' HA ' ' A' ' 109' ' ' TYR . 0.0 OUTLIER -91.07 -5.62 54.95 Favored 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 120.364 -0.534 . . . . 0.0 110.956 -179.188 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . 0.619 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 42.3 tt0 -69.97 -66.43 0.59 Allowed 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 174.496 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 28.3 pt20 -51.85 -31.73 29.06 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.579 -177.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -98.65 -72.15 0.66 Allowed 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.653 -177.003 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 14.4 m -71.27 -31.46 67.52 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -168.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . 0.619 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 15.7 t80 -64.48 -57.34 9.5 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 117.829 0.286 . . . . 0.0 110.633 -178.55 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 39.5 p -60.09 -46.65 88.88 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 121.372 0.606 . . . . 0.0 110.327 179.1 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 20.5 ttp85 -61.0 -31.3 70.91 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.831 178.633 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 86.0 t80 -70.87 -39.73 72.71 Favored 'General case' 0 C--O 1.225 -0.218 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 177.09 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 87.9 mt -62.34 -22.53 66.15 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.932 0.396 . . . . 0.0 110.403 178.023 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -101.44 -11.98 18.93 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.998 177.299 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 82.7 p -65.44 144.59 56.96 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 120.662 0.268 . . . . 0.0 111.013 -175.322 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -57.62 -31.14 65.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.214 177.076 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 2.3 mp -52.71 -53.18 21.99 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 CA-C-O 121.298 0.57 . . . . 0.0 110.254 175.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -61.91 -48.3 81.09 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.597 -178.114 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.471 ' HA ' ' HB2' ' A' ' 130' ' ' MET . 3.9 mm? -68.05 -20.35 64.97 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.106 -179.507 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -76.92 -26.27 53.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.065 0.46 . . . . 0.0 110.192 177.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 70.8 mt -82.49 -34.86 27.85 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 107.268 -1.382 . . . . 0.0 107.268 175.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' MET . . . . . 0.757 ' SD ' ' HB1' ' A' ' 8' ' ' ALA . 83.2 mmm -82.67 -165.24 1.0 Allowed 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 113.272 -1.785 . . . . 0.0 110.656 178.66 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -162.34 -34.09 0.04 OUTLIER 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 114.723 -1.126 . . . . 0.0 109.805 -177.578 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 124.7 55.78 0.18 Allowed Glycine 0 N--CA 1.45 -0.382 0 CA-C-N 116.138 -0.483 . . . . 0.0 112.575 175.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . 0.459 ' HA ' ' NE ' ' A' ' 133' ' ' ARG . 1.4 tpm_? -128.58 83.24 66.76 Favored Pre-proline 0 CA--C 1.531 0.25 0 CA-C-N 116.983 0.392 . . . . 0.0 110.776 175.708 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo . . . . . 0 N--CA 1.459 -0.51 0 C-N-CA 123.099 2.533 . . . . 0.0 111.727 175.291 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 49.0 m . . . . . 0 N--CA 1.477 0.908 0 CA-C-O 120.706 0.289 . . . . 0.0 110.698 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 45.3 ttp -135.98 20.19 3.25 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.597 0.713 . . . . 0.0 109.639 -179.373 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . 0.488 HG22 ' HB3' ' A' ' 7' ' ' GLU . 1.5 p -62.56 120.5 9.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.349 177.141 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 45.1 t -80.73 154.46 73.39 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.536 175.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_endo -48.12 -36.64 29.0 Favored 'Trans proline' 0 C--N 1.353 0.773 0 C-N-CA 122.701 2.268 . . . . 0.0 112.108 176.188 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.485 ' O ' ' HG2' ' A' ' 10' ' ' LYS . 33.5 mt-10 -70.28 -32.36 70.13 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 121.282 0.563 . . . . 0.0 110.543 178.421 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.488 ' HB3' HG22 ' A' ' 3' ' ' VAL . 18.9 tp10 -71.99 -32.63 67.4 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 176.583 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.94 -46.53 84.3 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.855 178.553 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.432 HG22 ' O ' ' A' ' 6' ' ' GLU . 19.8 m -66.45 -26.65 38.17 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.23 0 C-N-CA 121.054 -0.258 . . . . 0.0 110.491 179.026 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.485 ' HG2' ' O ' ' A' ' 6' ' ' GLU . 74.2 mmtt -62.81 -44.32 96.46 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.952 0.406 . . . . 0.0 110.016 172.334 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 39.0 m0 -64.49 -27.61 69.1 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.27 0.557 . . . . 0.0 109.863 176.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -76.99 -14.51 82.56 Favored Glycine 0 N--CA 1.449 -0.499 0 CA-C-N 115.326 -0.852 . . . . 0.0 112.647 178.47 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -69.84 -50.83 38.88 Favored 'General case' 0 CA--C 1.521 -0.173 0 CA-C-O 121.203 0.525 . . . . 0.0 110.279 178.129 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 28.6 m -152.45 134.07 14.61 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.602 -175.073 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.418 ' CE1' HD23 ' A' ' 18' ' ' LEU . 1.7 t80 -60.29 -35.06 74.71 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.478 -178.205 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -65.03 -32.98 74.97 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.459 179.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.618 ' HB2' ' HZ2' ' A' ' 17' ' ' LYS . 4.3 ttmp? -65.95 -38.46 88.64 Favored 'General case' 0 N--CA 1.464 0.253 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 177.146 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.418 HD23 ' CE1' ' A' ' 15' ' ' PHE . 56.5 tp -58.22 -46.81 85.2 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.947 174.677 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.426 ' HG ' ' HH2' ' A' ' 44' ' ' TRP . 6.7 mp -62.77 -37.56 87.14 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.191 177.631 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 52.4 m -73.06 -11.7 60.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.341 -177.531 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -98.26 114.18 26.37 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 179.549 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 10.7 mmt85 -50.27 -48.53 54.78 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.091 0.472 . . . . 0.0 111.129 177.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -69.25 -19.25 63.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.511 -179.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -80.47 -44.67 8.47 Favored Glycine 0 C--N 1.334 0.436 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.594 178.536 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 7.1 tp -50.51 -51.66 45.49 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.542 0.686 . . . . 0.0 109.913 173.2 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.44 ' O ' ' HG3' ' A' ' 30' ' ' ARG . 9.0 tp10 -58.93 -52.99 63.36 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.603 -1.18 . . . . 0.0 110.703 -178.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -58.38 -39.54 79.9 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.993 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -67.11 -49.26 65.55 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.801 -178.487 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.503 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 14.6 t -66.2 -36.68 83.7 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 110.363 -0.236 . . . . 0.0 110.363 -177.254 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.44 ' HG3' ' O ' ' A' ' 26' ' ' GLU . 62.9 mtp180 -57.52 -41.9 81.75 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 120.888 0.375 . . . . 0.0 110.513 176.889 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.532 ' O ' HG21 ' A' ' 34' ' ' THR . 51.3 t80 -72.64 -43.79 62.74 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.453 176.621 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.481 HD23 ' OD1' ' A' ' 40' ' ' ASN . 19.4 tp -62.08 -28.56 69.7 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.184 -174.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.532 ' HG2' ' HB3' ' A' ' 38' ' ' GLU . 99.2 mttt -79.78 -4.87 53.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.534 -179.583 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.532 HG21 ' O ' ' A' ' 31' ' ' PHE . 1.0 OUTLIER -84.62 -17.74 37.7 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 176.039 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -113.44 0.73 14.83 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.747 177.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 48.0 t80 68.28 16.79 9.33 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.804 174.708 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 31.7 m -85.28 9.17 16.03 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 121.099 0.476 . . . . 0.0 110.327 177.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.532 ' HB3' ' HG2' ' A' ' 33' ' ' LYS . 10.0 pt-20 -56.31 -19.31 13.76 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.429 -0.805 . . . . 0.0 112.454 -177.515 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.401 ' CD ' ' HZ3' ' A' ' 77' ' ' LYS . 5.7 mm-40 -50.04 -37.92 35.46 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.341 -179.744 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.526 ' ND2' ' HB3' ' A' ' 112' ' ' MET . 28.6 p30 -81.23 -39.04 25.98 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-N 115.934 -0.576 . . . . 0.0 112.224 -172.272 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.443 HG21 ' O ' ' A' ' 38' ' ' GLU . 9.8 tp -65.8 -43.64 93.26 Favored 'Isoleucine or valine' 0 C--O 1.234 0.254 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 -179.419 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.32 -31.8 72.81 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.735 176.359 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.408 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 81.7 t80 -55.11 -70.19 0.11 Allowed 'General case' 0 C--O 1.238 0.491 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.558 179.805 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.426 ' HH2' ' HG ' ' A' ' 19' ' ' LEU . 28.4 p-90 -81.72 -15.82 53.15 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 119.854 -0.738 . . . . 0.0 112.67 -171.418 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 10.8 tt -67.13 -35.76 75.15 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 173.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.49 -36.64 83.24 Favored 'General case' 0 N--CA 1.456 -0.128 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.574 173.546 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 72.8 m -66.32 -24.62 66.56 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.075 176.678 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.51 ' HA ' ' HB2' ' A' ' 51' ' ' LYS . 12.6 mm-40 -83.37 -22.87 32.67 Favored 'General case' 0 C--O 1.233 0.218 0 O-C-N 122.272 -0.268 . . . . 0.0 110.556 175.644 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.429 ' HA ' ' HG2' ' A' ' 52' ' ' LYS . 24.5 t70 -68.06 -42.56 80.28 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 168.327 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.419 ' CE1' HG21 ' A' ' 59' ' ' ILE . 6.3 t80 -57.02 -32.87 66.61 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.711 -1.132 . . . . 0.0 110.197 170.282 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.534 ' HB2' ' NZ ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -73.45 -40.42 64.19 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.297 -176.905 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.429 ' HG2' ' HA ' ' A' ' 49' ' ' ASP . 7.0 ptmm? -74.78 -26.63 59.88 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 120.579 0.228 . . . . 0.0 111.154 179.667 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 28.8 p -77.84 67.34 3.69 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-O 121.174 0.512 . . . . 0.0 109.691 175.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.767 ' HB2' ' HZ2' ' A' ' 54' ' ' LYS . 0.0 OUTLIER -77.08 16.96 0.49 Allowed 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.387 -0.824 . . . . 0.0 113.162 -170.937 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -68.94 133.78 27.06 Favored Glycine 0 CA--C 1.52 0.398 0 C-N-CA 120.451 -0.881 . . . . 0.0 110.937 176.052 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -54.21 -42.1 70.25 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.729 2.286 . . . . 0.0 112.642 -174.177 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -89.07 -29.1 19.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.17 0.51 . . . . 0.0 109.908 179.005 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.484 ' OE1' HD12 ' A' ' 61' ' ' LEU . 4.7 tp-100 -56.23 -42.25 76.99 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.714 178.296 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.419 HG21 ' CE1' ' A' ' 50' ' ' PHE . 29.9 mm -54.58 -39.6 46.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.308 178.295 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 19.9 m-70 -66.02 -52.06 52.67 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.185 -175.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.484 HD12 ' OE1' ' A' ' 58' ' ' GLN . 4.6 pp -69.74 -32.21 70.62 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.964 -177.459 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.482 ' N ' HD11 ' A' ' 61' ' ' LEU . 66.6 mmtt -66.69 -43.65 83.83 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 121.174 0.512 . . . . 0.0 109.997 174.91 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.22 -47.54 85.55 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.952 -179.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 3.5 tppp? -63.66 -35.37 80.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.502 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.83 -53.27 59.9 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.048 0.451 . . . . 0.0 110.401 177.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 65.5 mt -62.9 -37.62 79.71 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.392 178.154 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.526 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 71.9 t80 -57.21 -56.87 16.22 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.735 -179.487 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.412 ' HA ' ' HG2' ' A' ' 72' ' ' GLN . 42.8 mt-10 -70.69 -30.09 66.57 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.529 -175.203 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 58.2 tttm -90.9 -19.04 23.78 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.723 -173.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 99.4 m-85 -136.35 -53.2 0.73 Allowed 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -176.052 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.526 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 45.7 mm -73.1 -24.09 20.58 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -167.433 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.412 ' HG2' ' HA ' ' A' ' 68' ' ' GLU . 13.5 mm-40 -53.67 139.88 30.91 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 120.851 0.358 . . . . 0.0 111.244 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 65.2 m -71.97 69.68 0.73 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.609 0.719 . . . . 0.0 110.089 176.25 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 21.2 t70 170.59 -76.69 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 107.406 -1.331 . . . . 0.0 107.406 -178.274 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . 59.95 149.07 0.08 OUTLIER Pre-proline 0 CA--C 1.538 0.493 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 169.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -67.43 -20.07 48.5 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 122.508 2.139 . . . . 0.0 111.625 173.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.744 ' HA ' ' HE2' ' A' ' 77' ' ' LYS . 11.2 mmpt? -105.25 -19.7 13.73 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.149 -179.379 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 52.19 77.98 0.14 Allowed 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 121.317 0.58 . . . . 0.0 110.082 -175.704 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 59.0 t -84.94 117.52 30.35 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.95 -175.605 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -80.23 77.39 6.97 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.35 0.595 . . . . 0.0 110.35 179.261 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 20.5 tp -110.75 148.06 33.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.891 176.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.404 ' HB2' ' HG1' ' A' ' 85' ' ' THR . 2.8 m-20 -49.57 128.61 17.92 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.285 -178.271 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 38.2 p90 -52.19 -42.78 63.79 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.412 -179.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . 0.431 ' O ' HG22 ' A' ' 88' ' ' VAL . 68.7 t60 -68.07 -39.7 82.91 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.674 -0.239 . . . . 0.0 110.88 -178.385 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.404 ' HG1' ' HB2' ' A' ' 82' ' ' ASP . 40.6 m -63.71 -46.49 85.24 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.917 0.389 . . . . 0.0 110.547 -179.26 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 12.0 ptmm? -72.12 -21.95 61.4 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.153 179.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -69.92 -46.54 65.14 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.227 174.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.431 HG22 ' O ' ' A' ' 84' ' ' HIS . 87.6 t -54.84 -36.98 39.3 Favored 'Isoleucine or valine' 0 C--O 1.235 0.32 0 CA-C-O 121.287 0.565 . . . . 0.0 109.61 175.242 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 74.4 mt -63.15 -46.48 95.84 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.71 176.304 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 72.1 p -63.94 -22.57 66.98 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.067 0.46 . . . . 0.0 111.094 -179.215 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 79.6 m-20 -85.6 -31.1 22.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.542 178.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 20.7 m -98.2 -1.84 41.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.469 -176.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 11.0 tp -66.33 -15.01 18.47 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 CA-C-O 121.106 0.479 . . . . 0.0 111.238 -176.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 8.0 t -89.3 -6.95 56.31 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.909 178.487 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.487 ' N ' ' HD3' ' A' ' 96' ' ' PRO . 25.5 pt20 -160.79 56.92 0.81 Allowed Pre-proline 0 CA--C 1.536 0.43 0 CA-C-O 120.973 0.416 . . . . 0.0 110.495 -179.132 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . 0.487 ' HD3' ' N ' ' A' ' 95' ' ' GLN . 23.9 Cg_exo -63.06 134.19 44.82 Favored 'Trans proline' 0 C--N 1.351 0.698 0 C-N-CA 122.798 2.332 . . . . 0.0 112.501 -174.4 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' THR . . . . . 0.403 ' H ' ' HB2' ' A' ' 100' ' ' SER . 52.7 p -90.87 168.84 11.41 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.434 176.454 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 34.9 tp -55.54 -47.1 76.85 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 120.972 0.415 . . . . 0.0 111.151 -177.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . 0.437 ' HB3' ' HB2' ' A' ' 102' ' ' ASP . 45.9 m-70 -108.67 36.98 2.65 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.818 0.342 . . . . 0.0 110.492 178.558 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' SER . . . . . 0.403 ' HB2' ' H ' ' A' ' 97' ' ' THR . 15.6 t -59.22 -48.98 79.61 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.064 0.459 . . . . 0.0 110.511 178.341 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.473 ' O ' ' HG3' ' A' ' 105' ' ' GLN . 84.3 m-85 -80.21 -1.52 40.91 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.591 -177.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . 0.437 ' HB2' ' HB3' ' A' ' 99' ' ' HIS . 16.1 t70 -52.88 -42.71 65.54 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 120.993 0.425 . . . . 0.0 110.608 -176.875 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.575 ' O ' ' HG2' ' A' ' 107' ' ' ARG . . . -57.22 -51.31 69.85 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.464 176.699 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.69 -40.18 87.02 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.979 -179.314 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.473 ' HG3' ' O ' ' A' ' 101' ' ' PHE . 25.9 mt-30 -60.63 -43.86 97.04 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.921 178.645 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 25.8 t -62.23 -37.43 85.38 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.605 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . 0.575 ' HG2' ' O ' ' A' ' 103' ' ' ALA . 16.3 mmm180 -65.42 -60.53 2.86 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.051 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 53.7 t -53.46 -40.66 41.82 Favored 'Isoleucine or valine' 0 C--O 1.239 0.54 0 CA-C-O 121.39 0.614 . . . . 0.0 110.865 178.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . 0.55 ' HA ' ' HE2' ' A' ' 112' ' ' MET . 30.4 t80 -60.68 -51.89 67.44 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.312 -179.88 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.57 ' NE2' HD11 ' A' ' 111' ' ' LEU . 0.0 OUTLIER -61.81 -28.83 69.75 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 120.485 0.183 . . . . 0.0 110.509 -175.189 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.57 HD11 ' NE2' ' A' ' 110' ' ' GLN . 10.1 mp -60.56 -68.1 0.33 Allowed 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.316 175.179 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' MET . . . . . 0.55 ' HE2' ' HA ' ' A' ' 109' ' ' TYR . 0.0 OUTLIER -68.97 -12.46 61.69 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.475 -175.171 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . 0.544 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 44.5 tt0 -64.43 -63.8 1.04 Allowed 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 172.637 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 29.8 pt20 -68.62 -20.69 64.5 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.463 -175.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -95.3 -63.09 1.2 Allowed 'General case' 0 C--O 1.233 0.214 0 CA-C-O 120.748 0.308 . . . . 0.0 111.588 -179.289 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 23.8 m -86.22 -37.23 18.87 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 112.709 0.633 . . . . 0.0 112.709 -170.642 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . 0.544 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 31.3 t80 -64.25 -37.44 87.5 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 120.866 -0.333 . . . . 0.0 110.751 -176.036 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 24.5 p -59.45 -46.38 88.92 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 121.533 0.682 . . . . 0.0 109.74 175.15 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 22.4 mmt180 -60.81 -38.49 85.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.48 176.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -61.04 -41.12 95.98 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.444 178.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 87.6 mt -69.36 -22.63 63.72 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.309 -178.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . 0.72 ' HE3' ' HA ' ' A' ' 122' ' ' LYS . 0.0 OUTLIER -115.38 15.02 16.86 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.598 0.237 . . . . 0.0 111.602 178.61 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 96.2 p -74.7 145.86 42.76 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 120.939 0.4 . . . . 0.0 111.117 -179.217 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -56.08 -36.59 68.27 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.802 176.735 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.516 ' O ' ' HG ' ' A' ' 129' ' ' LEU . 8.2 tp -66.87 -40.68 86.33 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.553 -179.561 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 84.6 t80 -63.41 -42.88 98.77 Favored 'General case' 0 C--O 1.232 0.175 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 176.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 93.3 mt -64.32 -29.4 70.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.222 176.601 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . 0.41 ' O ' ' HA3' ' A' ' 132' ' ' GLY . 22.9 t70 -71.14 -29.67 65.52 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.934 177.159 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.516 ' HG ' ' O ' ' A' ' 125' ' ' ILE . 69.6 mt -75.19 -25.41 58.22 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.136 176.197 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -70.23 -67.36 0.5 Allowed 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.417 -179.08 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -96.26 -10.58 27.6 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.814 0.34 . . . . 0.0 111.508 -175.134 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . 0.41 ' HA3' ' O ' ' A' ' 128' ' ' ASP . . . -78.02 61.06 3.8 Favored Glycine 0 C--N 1.33 0.211 0 N-CA-C 110.555 -1.018 . . . . 0.0 110.555 175.33 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 48.0 ttt85 -53.09 111.02 2.31 Favored Pre-proline 0 C--N 1.325 -0.468 0 C-N-CA 123.514 0.726 . . . . 0.0 111.316 -174.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo . . . . . 0 C--N 1.35 0.625 0 C-N-CA 122.809 2.339 . . . . 0.0 112.478 -176.807 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 68.4 p . . . . . 0 N--CA 1.479 1.012 0 N-CA-C 110.384 -0.228 . . . . 0.0 110.384 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 65.6 mtt 66.16 -175.33 0.19 Allowed 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.62 178.477 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . 0.449 ' CG2' ' HB3' ' A' ' 7' ' ' GLU . 9.1 p -153.09 149.64 13.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.782 0.325 . . . . 0.0 111.326 -174.721 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 35.4 t -88.15 148.13 42.15 Favored Pre-proline 0 CA--C 1.534 0.344 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.809 177.359 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_exo -45.41 -33.76 9.57 Favored 'Trans proline' 0 C--N 1.357 0.984 0 C-N-CA 123.003 2.468 . . . . 0.0 112.772 178.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.441 ' O ' HG21 ' A' ' 9' ' ' VAL . 12.6 mm-40 -53.91 -65.01 0.64 Allowed 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.193 0.52 . . . . 0.0 110.734 177.058 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.449 ' HB3' ' CG2' ' A' ' 3' ' ' VAL . 8.1 tp10 -64.57 -33.21 75.39 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.095 -178.372 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.23 -48.24 82.34 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.496 -179.025 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.528 HG23 ' HD2' ' A' ' 10' ' ' LYS . 31.8 m -69.25 -28.52 39.03 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 C-N-CA 120.914 -0.314 . . . . 0.0 110.571 179.781 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.544 ' HA ' ' HG2' ' A' ' 13' ' ' GLU . 3.1 mptp? -68.59 -29.57 68.13 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.644 0.259 . . . . 0.0 110.689 175.649 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 50.7 m0 -63.89 -32.41 73.92 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 170.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -79.92 0.95 81.29 Favored Glycine 0 C--N 1.331 0.304 0 CA-C-N 115.362 -0.836 . . . . 0.0 113.099 -177.602 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.544 ' HG2' ' HA ' ' A' ' 10' ' ' LYS . 11.2 pt-20 -130.65 0.86 4.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.857 0.36 . . . . 0.0 110.418 177.236 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.1 m -152.46 99.02 2.44 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.494 -179.004 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -59.48 -36.01 75.2 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.141 0.496 . . . . 0.0 109.765 178.034 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -57.21 -38.31 73.52 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.277 176.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.71 ' HB2' ' HZ3' ' A' ' 17' ' ' LYS . 1.0 OUTLIER -75.69 -30.09 59.22 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.245 -0.888 . . . . 0.0 110.184 -173.37 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 65.8 tp -59.85 -47.2 86.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.68 173.334 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 7.5 mp -77.14 -25.37 51.95 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.987 178.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 42.8 t -62.45 -29.63 70.66 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.388 178.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -95.13 129.8 42.1 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.106 176.142 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.629 HH11 ' HB2' ' A' ' 26' ' ' GLU . 2.1 tmt_? -58.27 -33.46 69.44 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 176.557 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -61.85 -52.71 63.03 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.986 177.225 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -63.36 -37.8 95.41 Favored Glycine 0 C--N 1.334 0.419 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.89 -179.298 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 16.1 tp -54.16 -58.09 8.67 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.096 0.474 . . . . 0.0 110.481 175.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.629 ' HB2' HH11 ' A' ' 22' ' ' ARG . 15.6 tp10 -65.65 -40.8 92.86 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.534 -176.272 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.414 ' O ' ' HG3' ' A' ' 30' ' ' ARG . . . -61.14 -45.77 93.28 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-O 121.008 0.433 . . . . 0.0 110.71 179.072 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -70.92 -41.11 71.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.899 -177.49 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.506 HG22 ' HA ' ' A' ' 26' ' ' GLU . 14.9 t -69.93 -42.74 72.87 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 120.816 -0.354 . . . . 0.0 110.701 -177.917 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.45 ' NH1' HD13 ' A' ' 125' ' ' ILE . 0.0 OUTLIER -63.58 -27.32 69.17 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.037 0.446 . . . . 0.0 109.811 179.245 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.557 ' O ' HG22 ' A' ' 34' ' ' THR . 93.8 t80 -77.12 -44.3 30.92 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.701 -0.682 . . . . 0.0 109.802 174.068 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.405 HD22 ' HA ' ' A' ' 38' ' ' GLU . 22.9 tp -69.82 -16.63 63.31 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.789 -176.426 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.516 ' HG2' ' HG2' ' A' ' 38' ' ' GLU . 98.2 mttt -81.94 -18.21 44.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.492 179.294 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.557 HG22 ' O ' ' A' ' 31' ' ' PHE . 2.5 t -72.03 -28.48 63.39 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 121.286 0.565 . . . . 0.0 109.613 178.923 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -102.15 -1.64 31.01 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.283 176.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 94.5 m-85 52.63 67.66 0.95 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.373 -179.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 29.5 t -132.42 12.17 4.54 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.926 177.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.516 ' HG2' ' HG2' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -63.78 -18.0 63.64 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.969 179.364 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.42 ' HG3' ' N ' ' A' ' 40' ' ' ASN . 7.5 pt-20 -43.56 -42.5 5.08 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.027 171.775 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.489 ' HB3' HG12 ' A' ' 108' ' ' VAL . 57.1 m-80 -64.02 -46.45 84.42 Favored 'General case' 0 C--O 1.243 0.713 0 CA-C-N 115.329 -0.851 . . . . 0.0 111.404 -175.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.451 ' O ' HG13 ' A' ' 45' ' ' ILE . 32.4 mt -60.77 -51.75 69.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.171 179.831 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -64.57 -24.32 67.56 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.293 178.155 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.466 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 84.2 t80 -58.32 -60.98 2.92 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.711 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 6.7 p-90 -75.88 -17.73 59.68 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 119.762 -0.775 . . . . 0.0 111.854 -178.537 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.451 HG13 ' O ' ' A' ' 41' ' ' ILE . 33.6 mt -60.76 -47.04 94.9 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 170.578 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.41 -34.75 79.04 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.634 178.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.762 ' SG ' ' HB2' ' A' ' 101' ' ' PHE . 49.8 t -60.95 -41.68 96.78 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.507 178.831 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -71.53 -31.09 66.66 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 121.131 0.491 . . . . 0.0 109.997 179.136 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.772 ' HA ' ' HE2' ' A' ' 52' ' ' LYS . 77.8 m-20 -66.08 -32.12 73.4 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 121.308 0.575 . . . . 0.0 109.748 174.702 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 43.3 t80 -70.0 -35.53 74.44 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.455 176.212 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 6.1 tmtm? -58.9 -35.66 73.41 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.697 175.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.772 ' HE2' ' HA ' ' A' ' 49' ' ' ASP . 1.9 mppt? -58.25 -47.7 82.73 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.022 175.481 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 6.2 p -74.52 79.66 1.95 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.199 0.523 . . . . 0.0 110.627 -178.451 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.63 11.32 9.11 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 115.438 -0.801 . . . . 0.0 112.525 -176.299 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . 0.528 ' O ' HG12 ' A' ' 59' ' ' ILE . . . -69.3 126.61 19.77 Favored Glycine 0 CA--C 1.52 0.383 0 C-N-CA 120.81 -0.709 . . . . 0.0 111.521 177.344 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -52.84 -47.75 25.73 Favored 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 122.734 2.29 . . . . 0.0 113.081 -174.169 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 69.4 mt-30 -75.22 -40.85 58.76 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 178.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.537 ' O ' ' HB2' ' A' ' 62' ' ' LYS . 27.8 tp60 -51.17 -39.19 55.82 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 114.858 -1.065 . . . . 0.0 110.704 178.933 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.528 HG12 ' O ' ' A' ' 55' ' ' GLY . 29.6 mm -50.59 -48.41 26.85 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.596 179.527 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 46.2 m-70 -68.07 -54.23 19.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.994 -173.026 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.471 HD12 HE22 ' A' ' 58' ' ' GLN . 3.7 pp -69.42 -25.81 64.31 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.084 -176.704 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.537 ' HB2' ' O ' ' A' ' 58' ' ' GLN . 2.0 tmtm? -70.21 -45.73 66.0 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 175.473 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.51 -32.66 71.67 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.545 177.11 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . 0.407 ' O ' ' HB3' ' A' ' 67' ' ' TYR . 16.2 tppt? -58.94 -46.93 86.81 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.952 0.406 . . . . 0.0 110.267 174.921 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.23 -43.77 98.34 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.599 179.067 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 64.0 mt -68.76 -29.46 43.71 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.312 178.072 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.559 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 92.0 t80 -61.65 -63.83 1.14 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.325 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -61.22 -37.07 81.7 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.711 -175.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -83.46 -37.91 22.54 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -173.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -120.67 -50.14 2.21 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -171.506 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.559 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 49.2 mm -71.67 -31.08 40.68 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 CA-C-O 120.49 0.185 . . . . 0.0 111.36 -169.176 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 12.2 mm-40 -58.15 145.64 36.27 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.168 0.509 . . . . 0.0 111.233 178.513 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 27.7 m -77.47 -45.95 24.05 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 169.756 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -85.49 60.79 6.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.569 172.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.556 ' HB1' ' HA ' ' A' ' 78' ' ' GLU . . . -97.76 161.18 26.6 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.315 -178.685 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_exo -49.6 -53.25 7.35 Favored 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 122.798 2.332 . . . . 0.0 112.745 179.216 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.518 ' HD3' ' O ' ' A' ' 77' ' ' LYS . 1.4 tmtp? -108.99 -23.25 11.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.01 -179.126 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.556 ' HA ' ' HB1' ' A' ' 75' ' ' ALA . 36.4 mt-10 70.4 156.38 0.15 Allowed 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.435 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 50.7 t -130.5 133.09 64.18 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.643 176.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 35.9 m-80 -79.48 20.49 0.55 Allowed 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 122.617 0.367 . . . . 0.0 111.869 -176.326 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.404 HD11 HG21 ' A' ' 108' ' ' VAL . 14.1 tp -62.93 147.42 50.44 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.899 176.814 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -46.57 126.34 8.17 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.852 178.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.533 ' HA ' ' HD3' ' A' ' 86' ' ' LYS . 87.1 t80 -57.02 -39.58 75.04 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.181 -178.368 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 83.2 t60 -66.01 -29.74 70.16 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.714 0.292 . . . . 0.0 110.834 -178.266 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 56.8 m -71.43 -46.66 59.52 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 175.454 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.558 ' O ' HG22 ' A' ' 90' ' ' THR . 26.1 mtpp -55.99 -41.49 74.92 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.584 175.223 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -52.9 -59.72 4.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 114.887 -1.051 . . . . 0.0 111.107 -179.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 61.3 t -56.49 -40.71 69.57 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.908 -178.104 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 75.2 mt -66.92 -47.7 81.73 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.19 -178.113 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.558 HG22 ' O ' ' A' ' 86' ' ' LYS . 82.8 p -59.8 -31.27 69.55 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 120.922 0.392 . . . . 0.0 111.117 -176.694 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -85.13 -24.5 27.98 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.99 -179.784 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 32.3 t -97.0 2.14 51.11 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.802 -179.647 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.5 tp -53.3 -29.98 16.79 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.819 -177.156 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 8.8 t -61.85 -38.39 88.06 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.955 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -141.91 81.0 15.0 Favored Pre-proline 0 N--CA 1.464 0.259 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.502 -179.652 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . 0.434 ' HG2' HG22 ' A' ' 59' ' ' ILE . 93.2 Cg_endo -86.62 143.33 7.26 Favored 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 122.662 2.241 . . . . 0.0 111.706 176.566 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' THR . . . . . 0.402 ' H ' ' HB3' ' A' ' 100' ' ' SER . 36.7 p -79.39 171.55 15.01 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.135 177.559 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 36.2 tp -57.54 -30.63 65.36 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.61 -174.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . 0.413 ' O ' ' HB2' ' A' ' 102' ' ' ASP . 0.1 OUTLIER -132.63 43.55 2.97 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 177.939 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' SER . . . . . 0.402 ' HB3' ' H ' ' A' ' 97' ' ' THR . 6.3 p -53.12 -33.47 52.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.428 -0.806 . . . . 0.0 112.076 -178.723 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.762 ' HB2' ' SG ' ' A' ' 47' ' ' CYS . 38.7 m-85 -83.2 9.38 10.74 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.223 -176.807 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . 0.413 ' HB2' ' O ' ' A' ' 99' ' ' HIS . 19.0 t70 -56.94 -44.75 82.84 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 121.009 0.433 . . . . 0.0 110.966 -176.371 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.01 -31.98 71.58 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.57 178.078 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.46 -37.03 84.23 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.498 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -54.57 -41.68 70.13 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 120.826 0.346 . . . . 0.0 110.288 176.209 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 49.0 m -62.24 -53.37 56.13 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.592 -179.269 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 39.5 mmt-85 -57.49 -48.97 77.8 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.239 -179.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.489 HG12 ' HB3' ' A' ' 40' ' ' ASN . 71.2 t -64.29 -52.52 54.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.863 -176.027 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -56.11 -53.74 53.37 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.462 -176.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.1 -31.02 71.21 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.834 -175.043 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 54.4 tp -65.24 -47.97 74.92 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.506 -179.224 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 62.8 mtm -62.33 -39.35 92.78 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.176 0.512 . . . . 0.0 110.146 178.133 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . 0.608 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 38.4 tt0 -58.93 -62.5 1.83 Allowed 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.302 -175.848 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -54.4 -31.56 55.24 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 -169.338 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -105.28 -63.21 1.26 Allowed 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 112.085 0.402 . . . . 0.0 112.085 -175.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 22.5 t -70.52 -42.3 71.44 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.686 0.279 . . . . 0.0 111.101 -173.52 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . 0.608 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 28.3 t80 -67.48 -35.77 79.82 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.725 -0.216 . . . . 0.0 111.321 -175.495 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 29.8 p -65.45 -49.54 68.77 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-O 120.856 0.36 . . . . 0.0 110.366 178.538 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 38.4 ttt180 -62.54 -34.33 76.71 Favored 'General case' 0 C--O 1.225 -0.201 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 176.127 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 83.5 t80 -61.35 -33.85 74.32 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.198 177.223 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.491 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 81.5 mt -68.96 -24.74 64.29 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.767 0.317 . . . . 0.0 110.737 177.117 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 17.7 tptt -113.39 15.08 19.24 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 120.963 -0.295 . . . . 0.0 111.576 177.53 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 92.5 p -73.14 157.92 36.29 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.637 0.256 . . . . 0.0 110.53 -179.506 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -55.17 -28.32 52.02 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.041 0.448 . . . . 0.0 110.067 175.362 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.45 HD13 ' NH1' ' A' ' 30' ' ' ARG . 58.9 mt -62.43 -56.75 15.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.452 177.148 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' TYR . . . . . 0.497 ' OH ' ' HA ' ' A' ' 9' ' ' VAL . 32.0 t80 -70.21 -39.37 75.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.555 -175.004 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 98.5 mt -60.72 -32.28 71.55 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 121.099 0.476 . . . . 0.0 110.062 177.022 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -66.82 -36.84 83.29 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.231 177.053 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 72.4 mt -74.25 -29.26 61.6 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.753 177.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' MET . . . . . 0.668 ' HE2' ' HA ' ' A' ' 130' ' ' MET . 21.3 mmt -85.93 10.81 12.93 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.425 -177.853 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -55.52 98.0 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.297 0.57 . . . . 0.0 111.72 -177.017 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 83.79 -61.72 4.7 Favored Glycine 0 N--CA 1.45 -0.383 0 CA-C-N 115.493 -0.776 . . . . 0.0 113.458 171.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . 0.515 ' HD2' ' N ' ' A' ' 133' ' ' ARG . 3.2 mpt_? -95.51 126.57 45.16 Favored Pre-proline 0 C--N 1.327 -0.407 0 O-C-N 122.851 -0.205 . . . . 0.0 111.462 -171.43 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo . . . . . 0 C--N 1.35 0.617 0 C-N-CA 123.486 2.791 . . . . 0.0 111.489 175.18 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 33.8 m . . . . . 0 N--CA 1.476 0.858 0 CA-C-O 120.789 0.328 . . . . 0.0 110.373 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 23.8 mmt -136.45 97.18 3.51 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.756 176.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 2.6 p -66.09 137.87 24.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.151 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.6 m -119.75 162.37 33.2 Favored Pre-proline 0 CA--C 1.534 0.333 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.39 178.335 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo -41.83 -48.53 5.92 Favored 'Trans proline' 0 C--N 1.356 0.921 0 C-N-CA 123.16 2.574 . . . . 0.0 113.339 -179.802 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.629 ' O ' ' HG2' ' A' ' 10' ' ' LYS . 49.9 mt-10 -62.81 -40.81 98.51 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 120.749 0.309 . . . . 0.0 110.978 179.765 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 15.4 tp10 -63.47 -36.41 83.65 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.185 0.517 . . . . 0.0 109.729 177.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.08 -41.0 91.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.263 -179.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.543 HG23 ' O ' ' A' ' 6' ' ' GLU . 16.3 m -69.97 -25.11 27.27 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.239 0 C-N-CA 120.797 -0.361 . . . . 0.0 110.42 179.918 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.629 ' HG2' ' O ' ' A' ' 6' ' ' GLU . 74.6 mmtt -64.12 -32.22 73.7 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 121.377 0.608 . . . . 0.0 109.667 175.199 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 31.4 m0 -79.36 -33.49 42.89 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.437 176.594 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -72.38 -0.49 46.71 Favored Glycine 0 C--N 1.334 0.441 0 CA-C-N 115.308 -0.86 . . . . 0.0 112.975 -179.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -115.51 -4.66 12.26 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.848 0.324 . . . . 0.0 110.889 176.506 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 43.7 t -165.32 111.05 0.92 Allowed 'General case' 0 C--O 1.234 0.264 0 CA-C-O 120.862 0.363 . . . . 0.0 111.247 -177.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 41.4 t80 -63.15 -32.95 74.46 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 174.381 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -58.75 -39.44 80.95 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.034 -0.984 . . . . 0.0 110.588 174.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.467 ' HD2' ' O ' ' A' ' 10' ' ' LYS . 38.8 ttmt -76.27 -33.86 59.12 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.402 -179.878 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 53.4 tp -55.76 -46.62 77.84 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 121.203 0.525 . . . . 0.0 110.197 176.16 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.419 HD23 ' CZ2' ' A' ' 44' ' ' TRP . 4.4 mp -76.05 -23.77 55.11 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.851 179.748 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.0 t -70.97 -25.73 62.84 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.927 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -97.8 123.53 41.8 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 69.4 mtp180 -52.66 -39.47 61.87 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 120.738 0.304 . . . . 0.0 110.859 -179.147 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -54.84 -47.25 74.38 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.683 -0.69 . . . . 0.0 109.996 177.613 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -71.21 -40.23 61.49 Favored Glycine 0 N--CA 1.45 -0.367 0 CA-C-N 115.385 -0.825 . . . . 0.0 112.0 -179.119 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.404 ' O ' HG21 ' A' ' 29' ' ' THR . 10.0 tt -58.66 -47.99 82.58 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 178.635 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -57.42 -57.14 13.95 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.333 178.331 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -58.38 -40.81 83.34 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.361 -177.346 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 93.2 t80 -74.31 -40.99 61.87 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.722 -175.572 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.628 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 11.7 t -72.54 -41.12 66.15 Favored 'General case' 0 CA--C 1.515 -0.39 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 -175.893 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 11.0 ttm180 -56.18 -42.16 76.64 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.167 173.433 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.469 ' O ' HG22 ' A' ' 34' ' ' THR . 89.1 t80 -67.46 -28.98 68.32 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.993 179.063 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 32.4 tp -86.58 -27.61 23.8 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 121.062 0.458 . . . . 0.0 110.869 -178.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.628 ' HG3' ' O ' ' A' ' 29' ' ' THR . 68.3 mttm -72.57 -17.93 61.66 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.874 179.807 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.469 HG22 ' O ' ' A' ' 31' ' ' PHE . 4.3 t -62.15 -27.25 68.81 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 120.915 0.388 . . . . 0.0 110.471 179.351 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -111.55 5.83 19.7 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.759 179.655 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 63.05 24.49 14.53 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 115.782 -0.645 . . . . 0.0 112.36 176.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 28.5 m -97.19 19.23 13.36 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.298 0.57 . . . . 0.0 110.279 177.246 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.504 ' HB3' ' HG2' ' A' ' 33' ' ' LYS . 11.8 pt-20 -62.14 -24.96 67.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.24 -0.891 . . . . 0.0 112.332 -173.604 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.424 ' O ' ' HB2' ' A' ' 43' ' ' PHE . 11.3 mp0 -51.61 -22.3 3.22 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -176.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.56 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 47.4 m-80 -71.65 -60.84 2.02 Favored 'General case' 0 C--O 1.242 0.676 0 CA-C-O 121.115 0.483 . . . . 0.0 110.901 -179.738 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.46 ' O ' HG13 ' A' ' 45' ' ' ILE . 8.4 tt -62.69 -41.02 90.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 179.37 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.452 ' OE1' ' HB2' ' A' ' 38' ' ' GLU . 0.9 OUTLIER -64.74 -27.0 68.61 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.068 176.227 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.56 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 77.6 t80 -58.85 -59.03 6.1 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 120.703 0.287 . . . . 0.0 110.536 178.061 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.421 ' HB2' ' HG2' ' A' ' 105' ' ' GLN . 28.5 p-90 -74.34 -14.79 60.93 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 119.377 -0.929 . . . . 0.0 111.665 -177.162 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.46 HG13 ' O ' ' A' ' 41' ' ' ILE . 68.2 mt -71.16 -37.3 66.03 Favored 'Isoleucine or valine' 0 C--O 1.238 0.461 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 169.231 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.59 -27.04 68.68 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.961 175.473 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.424 ' SG ' ' HB2' ' A' ' 101' ' ' PHE . 53.1 t -62.44 -29.05 70.23 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.038 175.258 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.489 ' O ' ' HG2' ' A' ' 51' ' ' LYS . 19.1 mt-10 -72.31 -41.0 67.07 Favored 'General case' 0 N--CA 1.458 -0.058 0 N-CA-C 109.784 -0.451 . . . . 0.0 109.784 174.397 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -61.36 -26.38 67.79 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.025 0.44 . . . . 0.0 110.377 174.075 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -73.95 -46.14 45.89 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.984 177.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.489 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 64.3 pttt -70.2 -23.1 62.89 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 116.759 -0.2 . . . . 0.0 111.422 -175.459 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.477 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 19.3 ptmt -90.37 7.96 35.95 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -177.367 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 65.9 m -54.54 119.16 4.86 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 120.807 0.337 . . . . 0.0 110.443 178.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.14 -19.45 65.6 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.782 -175.673 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -125.4 148.47 16.88 Favored Glycine 0 C--N 1.331 0.304 0 C-N-CA 120.95 -0.643 . . . . 0.0 112.402 -177.231 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -67.93 -32.55 28.55 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.683 2.255 . . . . 0.0 111.987 -179.082 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -71.66 -34.48 69.77 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 177.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 56.6 tp60 -58.7 -32.45 69.18 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.123 178.745 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.475 HG23 ' HG2' ' A' ' 96' ' ' PRO . 33.9 mm -55.23 -45.44 77.54 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.496 175.668 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 40.5 m-70 -66.19 -40.92 90.76 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.115 -178.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 77.6 mt -63.91 -49.99 70.49 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.02 -178.599 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.527 ' HA ' ' HE2' ' A' ' 62' ' ' LYS . 9.0 mmpt? -65.55 -42.98 91.26 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.833 -178.701 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.58 -46.78 86.21 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.804 179.648 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 6.7 tmtt? -63.39 -37.04 85.72 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.238 179.315 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.16 -51.91 65.93 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.561 179.054 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 72.6 mt -62.38 -36.01 72.51 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.193 178.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.559 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 74.3 t80 -58.48 -63.89 1.12 Allowed 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.489 178.849 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -54.72 -40.12 68.91 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.984 -174.608 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 56.3 tttm -96.41 -16.64 21.11 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 112.478 0.547 . . . . 0.0 112.478 -168.085 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -135.02 -53.37 0.8 Allowed 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 112.705 0.632 . . . . 0.0 112.705 -174.522 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.559 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 48.5 mm -67.41 -41.69 86.48 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 CA-C-O 120.618 0.247 . . . . 0.0 111.401 -170.047 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 51.2 tp60 -50.69 131.46 25.66 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.509 -178.358 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 20.4 m -54.82 -31.49 59.25 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.808 -174.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -114.9 32.52 5.97 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.049 0.452 . . . . 0.0 110.749 -178.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.53 ' HB1' ' HA ' ' A' ' 78' ' ' GLU . . . -60.44 158.61 28.53 Favored Pre-proline 0 CA--C 1.537 0.481 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.056 179.108 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.492 ' HD2' ' HB3' ' A' ' 75' ' ' ALA . 2.0 Cg_endo -44.05 -54.31 3.96 Favored 'Trans proline' 0 C--N 1.358 1.031 0 C-N-CA 123.672 2.915 . . . . 0.0 113.458 -175.579 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 43.2 mtpt -107.16 -19.28 13.65 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 110.313 -0.254 . . . . 0.0 110.313 175.16 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.53 ' HA ' ' HB1' ' A' ' 75' ' ' ALA . 10.0 pt-20 52.89 162.84 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.969 1.308 . . . . 0.0 113.282 -179.855 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.418 ' C ' ' H ' ' A' ' 81' ' ' LEU . 64.5 t -126.87 137.57 57.46 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 CA-C-N 114.856 -1.066 . . . . 0.0 108.835 174.572 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.402 ' HB2' HD22 ' A' ' 111' ' ' LEU . 17.6 m120 -74.63 20.56 0.12 Allowed 'General case' 0 N--CA 1.469 0.513 0 O-C-N 123.272 0.358 . . . . 0.0 111.851 -176.34 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.418 ' H ' ' C ' ' A' ' 79' ' ' VAL . 61.9 tp -50.07 134.42 21.93 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.487 175.034 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -47.43 140.59 5.6 Favored 'General case' 0 N--CA 1.469 0.475 0 O-C-N 123.475 0.484 . . . . 0.0 111.974 -177.744 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 99.1 m-85 -58.25 -48.27 80.97 Favored 'General case' 0 C--N 1.333 -0.109 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.705 -177.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 83.1 t60 -59.89 -37.31 79.02 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.048 -179.478 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 25.8 m -67.88 -49.94 59.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.872 -178.547 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.518 ' O ' HG23 ' A' ' 90' ' ' THR . 17.9 ptpt -72.55 -21.33 61.18 Favored 'General case' 0 C--O 1.227 -0.112 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.451 179.278 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 14.4 tp10 -57.89 -55.23 37.52 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 173.641 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 59.7 t -52.84 -49.37 47.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.926 176.47 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 68.3 mt -58.27 -44.14 87.49 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.853 -177.822 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.518 HG23 ' O ' ' A' ' 86' ' ' LYS . 64.2 p -61.28 -29.21 69.72 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 120.791 0.329 . . . . 0.0 110.824 -177.618 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 56.5 m-80 -88.51 -37.81 15.46 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.669 179.678 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 61.9 p -100.53 11.45 39.44 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 112.011 0.375 . . . . 0.0 112.011 -174.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.3 tp -58.37 -24.58 25.17 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 CA-C-O 120.984 0.421 . . . . 0.0 111.391 -178.457 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 8.8 t -76.45 -15.78 59.83 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.588 -179.199 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 16.3 pt20 -135.41 58.69 27.18 Favored Pre-proline 0 CA--C 1.538 0.496 0 CA-C-O 120.903 0.382 . . . . 0.0 110.979 -177.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . 0.475 ' HG2' HG23 ' A' ' 59' ' ' ILE . 85.3 Cg_endo -81.62 122.47 4.0 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.656 2.237 . . . . 0.0 112.401 -176.309 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 11.5 m -71.42 161.7 30.62 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.197 177.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -51.21 -38.74 54.09 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 122.502 0.321 . . . . 0.0 111.654 -177.611 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 28.7 m-70 -113.21 38.88 2.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.075 0.464 . . . . 0.0 110.884 178.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 17.2 p -62.29 -53.07 60.48 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.254 0.55 . . . . 0.0 110.476 177.031 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.424 ' HB2' ' SG ' ' A' ' 47' ' ' CYS . 94.8 m-85 -74.11 -0.98 18.27 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.358 -179.801 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . 0.489 ' O ' ' HB3' ' A' ' 105' ' ' GLN . 14.6 t70 -61.71 -33.25 73.69 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.13 0.49 . . . . 0.0 109.966 178.621 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.29 -41.57 96.82 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.896 174.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.94 -29.6 69.51 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.198 177.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.489 ' HB3' ' O ' ' A' ' 102' ' ' ASP . 21.7 tm0? -56.03 -52.29 64.77 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.922 177.005 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 31.5 t -62.06 -38.47 88.92 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.559 179.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 6.2 mmp_? -61.3 -54.43 44.05 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.951 179.315 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 96.8 t -64.56 -36.63 77.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 121.309 0.576 . . . . 0.0 110.369 -179.31 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -55.99 -50.57 70.46 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.737 176.477 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -73.76 -29.21 62.08 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 120.821 0.344 . . . . 0.0 110.551 -179.205 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.427 ' O ' ' HG2' ' A' ' 114' ' ' GLN . 57.0 tp -62.85 -43.52 98.58 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.494 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 58.8 mtm -75.63 -35.44 60.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.052 177.41 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . 0.424 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 3.7 tm-20 -52.31 -53.46 44.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.938 -177.811 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . 0.427 ' HG2' ' O ' ' A' ' 111' ' ' LEU . 4.3 pt20 -54.29 -17.04 2.52 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 112.732 0.641 . . . . 0.0 112.732 -172.831 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 42.4 m-20 -124.88 -68.16 0.87 Allowed 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.225 0.536 . . . . 0.0 110.795 178.515 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 5.0 m -59.09 -29.7 67.55 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.422 -0.808 . . . . 0.0 112.455 -171.309 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . 0.424 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 19.6 t80 -65.87 -59.07 4.22 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 120.55 0.214 . . . . 0.0 110.93 -177.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 1.3 p -60.97 -38.35 85.65 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.657 0.265 . . . . 0.0 110.926 179.278 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 78.9 mtp85 -58.15 -42.31 85.62 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.001 0.429 . . . . 0.0 110.01 175.194 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -64.14 -38.99 93.03 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.416 178.045 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 92.8 mt -66.76 -21.62 66.05 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.232 -179.217 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? -108.75 -0.94 19.72 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 120.662 0.268 . . . . 0.0 111.488 179.442 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 80.4 p -66.3 152.69 44.42 Favored 'General case' 0 C--O 1.237 0.407 0 O-C-N 122.256 -0.277 . . . . 0.0 110.519 179.613 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -54.47 -31.88 56.61 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 175.717 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.547 ' O ' ' HG ' ' A' ' 129' ' ' LEU . 72.9 mt -55.66 -59.06 2.96 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.174 0 CA-C-N 115.177 -0.919 . . . . 0.0 110.678 178.518 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 58.4 t80 -59.53 -43.94 93.33 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.021 -174.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -66.44 -31.55 72.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.794 179.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -71.04 -35.41 71.96 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.015 177.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.547 ' HG ' ' O ' ' A' ' 125' ' ' ILE . 47.8 mt -59.88 -40.46 88.77 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.915 178.358 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' MET . . . . . . . . . . . . . 23.5 mmt -64.62 -63.97 0.99 Allowed 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.835 175.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . 0.676 ' HG2' ' H ' ' A' ' 133' ' ' ARG . 0.0 OUTLIER -176.08 -40.21 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.182 175.14 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 56.98 30.63 60.54 Favored Glycine 0 C--N 1.333 0.384 0 C-N-CA 121.175 -0.536 . . . . 0.0 112.192 -178.139 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . 0.676 ' H ' ' HG2' ' A' ' 131' ' ' GLU . 77.6 ttt180 -152.95 85.62 4.29 Favored Pre-proline 0 C--O 1.234 0.286 0 CA-C-O 120.625 0.25 . . . . 0.0 110.965 -177.762 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_endo . . . . . 0 N--CA 1.457 -0.646 0 C-N-CA 122.909 2.406 . . . . 0.0 110.443 168.557 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 47.6 t . . . . . 0 N--CA 1.476 0.844 0 CA-C-O 121.103 0.478 . . . . 0.0 110.196 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 26.4 mmt -128.22 17.63 6.57 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 176.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . 0.614 HG12 HD11 ' A' ' 129' ' ' LEU . 2.9 p -106.56 131.05 57.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.068 -0.969 . . . . 0.0 111.792 -173.914 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.41 ' OG ' ' HD2' ' A' ' 5' ' ' PRO . 47.1 t -100.24 156.58 35.11 Favored Pre-proline 0 C--N 1.326 -0.415 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 170.817 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.41 ' HD2' ' OG ' ' A' ' 4' ' ' SER . 72.3 Cg_exo -42.62 -37.88 5.9 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 122.519 2.146 . . . . 0.0 112.73 176.8 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.529 ' O ' HG23 ' A' ' 9' ' ' VAL . 7.0 mm-40 -67.4 -43.12 82.06 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 121.603 0.716 . . . . 0.0 110.16 176.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.515 ' HB3' HG21 ' A' ' 3' ' ' VAL . 14.8 tp10 -67.46 -23.31 65.49 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.379 -0.828 . . . . 0.0 109.973 178.922 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.475 ' HB1' ' HE2' ' A' ' 130' ' ' MET . . . -73.9 -47.22 39.45 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.792 178.644 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.529 HG23 ' O ' ' A' ' 6' ' ' GLU . 19.3 m -63.42 -24.13 35.09 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 C-N-CA 121.091 -0.244 . . . . 0.0 110.527 179.745 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.501 ' O ' ' HD2' ' A' ' 17' ' ' LYS . 32.6 mmtp -51.99 -46.91 65.06 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 121.343 0.592 . . . . 0.0 110.224 172.175 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 33.5 m0 -64.51 -28.22 69.51 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.563 -176.163 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -74.62 -11.04 83.12 Favored Glycine 0 N--CA 1.452 -0.256 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.401 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -80.98 -24.77 37.79 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 120.831 0.348 . . . . 0.0 110.543 179.112 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 45.8 t -172.57 131.88 0.57 Allowed 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.661 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -61.52 -25.5 67.32 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.649 174.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -68.65 -35.71 77.62 Favored 'General case' 0 N--CA 1.461 0.114 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.007 176.129 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.501 ' HD2' ' O ' ' A' ' 10' ' ' LYS . 35.6 ttmt -70.25 -36.92 74.78 Favored 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 115.998 -0.546 . . . . 0.0 109.928 179.313 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 48.8 tp -58.43 -45.89 87.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.201 174.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.7 mp -74.78 -30.64 61.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.932 -177.311 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.466 ' HG ' ' HA ' ' A' ' 17' ' ' LYS . 69.7 p -78.35 -27.19 46.95 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 120.945 0.402 . . . . 0.0 110.364 178.787 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 24.0 t-80 -72.75 110.3 6.98 Favored 'General case' 0 C--O 1.221 -0.4 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 176.305 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.18 -53.49 16.67 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 121.2 0.524 . . . . 0.0 111.019 -175.238 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -68.81 -20.66 64.33 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.827 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -78.56 -53.41 4.68 Favored Glycine 0 C--N 1.332 0.329 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.795 -179.461 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.9 tt -51.71 -38.4 54.99 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 123.223 0.609 . . . . 0.0 110.682 174.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.624 ' O ' ' HG2' ' A' ' 30' ' ' ARG . 10.5 tp10 -62.35 -53.67 51.65 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.88 176.847 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -55.37 -44.97 76.55 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-O 121.293 0.568 . . . . 0.0 110.932 179.772 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.406 ' CE2' HD23 ' A' ' 32' ' ' LEU . 75.3 t80 -64.2 -44.14 92.89 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.872 -179.274 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.579 HG22 ' O ' ' A' ' 26' ' ' GLU . 4.0 t -67.01 -27.79 67.71 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.067 -177.941 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.624 ' HG2' ' O ' ' A' ' 26' ' ' GLU . 35.0 mmt180 -54.95 -52.89 61.6 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 173.305 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.551 ' O ' HG23 ' A' ' 34' ' ' THR . 84.3 t80 -68.21 -45.59 72.94 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.945 -179.141 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.406 HD23 ' CE2' ' A' ' 28' ' ' PHE . 21.5 tp -63.56 -29.85 71.04 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.003 0.43 . . . . 0.0 111.179 -175.344 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.423 ' HE2' ' OG1' ' A' ' 29' ' ' THR . 67.6 mttm -80.75 -9.69 59.78 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.559 179.295 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.551 HG23 ' O ' ' A' ' 31' ' ' PHE . 0.7 OUTLIER -84.13 -28.28 27.56 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 177.955 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -98.41 4.67 48.47 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.716 178.113 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 87.1 m-85 65.16 18.01 11.27 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.811 176.051 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 25.5 m -97.21 15.01 23.97 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 121.045 0.45 . . . . 0.0 110.641 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -56.08 -24.23 38.77 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.338 -179.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -45.62 -43.6 12.43 Favored 'General case' 0 C--O 1.225 -0.203 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.628 176.7 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.507 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 2.0 m-20 -57.67 -59.24 5.5 Favored 'General case' 0 C--O 1.245 0.837 0 CA-C-O 121.448 0.642 . . . . 0.0 112.007 -175.288 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.479 ' O ' HG13 ' A' ' 45' ' ' ILE . 13.2 tt -61.64 -42.4 94.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.043 -175.807 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.445 ' HA ' ' HB ' ' A' ' 45' ' ' ILE . 49.3 mt-10 -78.96 -10.01 59.69 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.069 -178.943 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.507 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 72.5 t80 -67.73 -59.28 3.44 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 175.311 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.438 ' HA ' ' SG ' ' A' ' 47' ' ' CYS . 32.1 p-90 -76.06 -19.01 58.97 Favored 'General case' 0 N--CA 1.463 0.215 0 C-N-CA 119.887 -0.725 . . . . 0.0 111.414 -178.861 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.479 HG13 ' O ' ' A' ' 41' ' ' ILE . 54.7 mt -62.92 -39.53 85.43 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 169.901 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.24 -35.64 81.67 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.214 175.408 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.438 ' SG ' ' HA ' ' A' ' 44' ' ' TRP . 67.4 m -63.94 -33.55 75.97 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.32 177.03 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.647 ' O ' ' HG2' ' A' ' 51' ' ' LYS . 9.0 mm-40 -66.72 -52.89 39.29 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 173.4 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -53.31 -26.31 18.22 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.349 0.595 . . . . 0.0 110.325 178.265 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.409 ' HD1' ' HD3' ' A' ' 62' ' ' LYS . 41.8 t80 -74.28 -40.3 62.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.334 177.48 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.647 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 59.9 pttt -66.94 -18.13 65.24 Favored 'General case' 0 N--CA 1.471 0.591 0 O-C-N 121.993 -0.442 . . . . 0.0 110.777 -178.302 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -72.7 -27.3 61.99 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.859 177.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 67.1 p -59.73 124.04 18.87 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 121.092 0.472 . . . . 0.0 110.419 -177.374 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.98 -14.23 16.03 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.752 -177.892 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -83.39 119.39 4.88 Favored Glycine 0 N--CA 1.448 -0.505 0 CA-C-N 115.934 -0.576 . . . . 0.0 112.03 -179.082 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_exo -53.15 -33.54 64.68 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.86 2.373 . . . . 0.0 112.014 179.062 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 20.3 mp0 -71.67 -39.66 70.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.614 178.495 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 55.4 tp60 -61.83 -40.55 95.66 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.26 -178.341 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 44.4 mm -49.53 -51.35 15.12 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.248 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.972 -178.853 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 79.2 m-70 -64.43 -55.1 23.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.692 -0.686 . . . . 0.0 111.688 -175.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.491 HD13 ' N ' ' A' ' 62' ' ' LYS . 4.3 pp -71.22 -30.16 66.01 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.805 -173.277 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.491 ' N ' HD13 ' A' ' 61' ' ' LEU . 57.6 tttp -74.29 -43.4 56.96 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 -179.88 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.33 -36.05 82.41 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.252 176.033 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 6.7 tmtt? -63.18 -36.76 84.71 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 115.659 -0.7 . . . . 0.0 109.971 179.026 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -66.87 -55.42 14.84 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.482 177.585 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 66.9 mt -56.31 -35.68 43.93 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-O 121.365 0.602 . . . . 0.0 110.238 178.431 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 76.2 t80 -56.08 -56.85 15.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.071 -0.968 . . . . 0.0 110.52 178.11 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.477 ' HA ' ' HB2' ' A' ' 72' ' ' GLN . 34.3 mt-10 -77.88 -18.22 56.43 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.543 -174.638 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -82.06 -36.73 27.38 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.132 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -126.47 -51.55 1.5 Allowed 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 112.135 0.421 . . . . 0.0 112.135 -174.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 33.7 mm -71.98 -15.51 18.11 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.373 0 CA-C-O 121.063 0.459 . . . . 0.0 111.34 -171.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.477 ' HB2' ' HA ' ' A' ' 68' ' ' GLU . 16.5 tm0? -58.71 132.79 54.92 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.477 179.143 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.9 m -55.05 -37.3 66.55 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 112.613 0.597 . . . . 0.0 112.613 -170.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -84.02 -67.35 0.8 Allowed 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 110.116 -0.327 . . . . 0.0 110.116 179.109 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . 64.06 156.84 0.12 Allowed Pre-proline 0 CA--C 1.539 0.53 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.682 178.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -73.31 -7.29 20.23 Favored 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 122.438 2.092 . . . . 0.0 112.586 -178.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.434 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 46.6 tttm -145.28 7.92 1.18 Allowed 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.591 -177.873 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 38.4 86.24 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.65 0.78 . . . . 0.0 112.266 -174.596 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 54.3 t -56.28 132.91 20.47 Favored 'Isoleucine or valine' 0 C--O 1.232 0.16 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.291 -179.376 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 43.9 m-80 -76.25 14.99 0.63 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 116.232 -0.44 . . . . 0.0 112.178 -173.31 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.457 ' O ' ' NZ ' ' A' ' 86' ' ' LYS . 57.7 tp -62.22 133.81 55.68 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 175.537 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -61.36 167.62 3.15 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-O 121.168 0.509 . . . . 0.0 111.785 -176.356 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 92.9 t80 -69.74 -43.97 71.22 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.162 -177.211 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . 0.46 ' O ' HG22 ' A' ' 88' ' ' VAL . 80.6 t60 -58.83 -51.83 68.32 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.446 -174.887 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 43.7 m -63.7 -42.76 97.93 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.519 -176.001 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.457 ' NZ ' ' O ' ' A' ' 81' ' ' LEU . 8.0 ptpp? -67.31 -33.03 74.42 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 120.586 -0.445 . . . . 0.0 109.984 179.236 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -61.86 -45.53 93.37 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.223 0.535 . . . . 0.0 109.898 177.554 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.46 HG22 ' O ' ' A' ' 84' ' ' HIS . 88.2 t -54.86 -43.14 66.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.976 176.583 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 72.4 mt -65.44 -43.76 94.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.886 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 39.9 p -63.72 -25.05 68.02 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 111.683 0.253 . . . . 0.0 111.683 -176.525 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 60.5 m-80 -90.43 -22.94 21.18 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 120.706 0.289 . . . . 0.0 111.16 177.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 29.3 t -100.24 -5.48 27.51 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.714 -0.221 . . . . 0.0 111.348 -177.373 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 9.9 tp -62.68 -23.55 33.05 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 CA-C-N 116.683 -0.235 . . . . 0.0 111.608 -175.819 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 6.8 t -58.6 -49.42 77.52 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-O 120.737 0.304 . . . . 0.0 110.88 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 21.6 mt-30 -139.43 81.53 20.26 Favored Pre-proline 0 C--O 1.235 0.316 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 178.352 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -83.1 162.5 15.52 Favored 'Trans proline' 0 CA--C 1.532 0.414 0 C-N-CA 122.834 2.356 . . . . 0.0 112.939 -176.281 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 77.1 p -90.35 174.78 7.39 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.119 174.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 9.2 mp -63.72 -11.86 29.66 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 120.828 0.347 . . . . 0.0 111.507 -178.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . 0.432 ' O ' ' HB2' ' A' ' 102' ' ' ASP . 0.2 OUTLIER -143.64 37.34 1.33 Allowed 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 -178.386 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 22.9 t -57.28 -22.86 44.53 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.969 -176.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 82.8 m-85 -88.93 15.37 8.62 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.797 0.332 . . . . 0.0 110.616 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . 0.534 ' HA ' ' NE2' ' A' ' 105' ' ' GLN . 20.5 t70 -54.67 -53.12 58.97 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.75 -173.768 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.436 ' O ' ' HG2' ' A' ' 107' ' ' ARG . . . -59.98 -37.51 79.84 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 120.993 0.425 . . . . 0.0 111.002 178.807 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.74 -37.73 85.33 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.012 -178.096 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.534 ' NE2' ' HA ' ' A' ' 102' ' ' ASP . 29.4 mt-30 -54.86 -57.02 13.28 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-O 121.286 0.565 . . . . 0.0 109.587 177.932 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' SER . . . . . 0.671 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 20.0 m -55.94 -45.58 78.77 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 114.735 -1.12 . . . . 0.0 110.828 -176.86 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . 0.491 ' O ' ' HG ' ' A' ' 111' ' ' LEU . 39.8 mmt180 -54.08 -57.97 9.08 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.974 0.416 . . . . 0.0 111.004 -179.56 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.537 ' HA ' HD11 ' A' ' 111' ' ' LEU . 46.3 t -63.17 -33.45 60.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.566 -178.002 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . 0.44 ' HA ' ' HE2' ' A' ' 112' ' ' MET . 48.3 t80 -59.14 -45.33 91.22 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.762 177.655 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.671 ' HG3' ' O ' ' A' ' 106' ' ' SER . 29.7 mt-30 -61.07 -40.92 95.52 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.528 0.68 . . . . 0.0 109.684 178.063 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.537 HD11 ' HA ' ' A' ' 108' ' ' VAL . 94.4 mt -58.04 -54.12 50.5 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.538 -1.21 . . . . 0.0 112.432 -172.296 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' MET . . . . . 0.472 ' HB3' ' ND2' ' A' ' 40' ' ' ASN . 0.0 OUTLIER -85.59 -12.38 51.68 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 119.864 -0.734 . . . . 0.0 110.922 -177.654 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . 0.665 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 38.4 tt0 -63.71 -66.69 0.51 Allowed 'General case' 0 C--O 1.233 0.231 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 174.074 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -50.91 -32.32 20.32 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.676 -177.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . 0.548 ' O ' ' HD3' ' A' ' 119' ' ' ARG . 25.1 t70 -97.84 -76.5 0.52 Allowed 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.612 -176.68 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 23.0 t -62.8 -38.18 89.67 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -171.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . 0.665 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 31.0 t80 -64.98 -38.88 92.42 Favored 'General case' 0 N--CA 1.468 0.454 0 O-C-N 122.287 -0.258 . . . . 0.0 111.157 -176.471 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 27.8 p -67.73 -42.03 82.51 Favored 'General case' 0 C--O 1.24 0.568 0 CA-C-O 121.063 0.459 . . . . 0.0 110.541 179.41 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . 0.548 ' HD3' ' O ' ' A' ' 115' ' ' ASP . 10.5 mpt_? -66.54 -34.84 78.79 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.005 176.267 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 86.3 t80 -60.83 -42.27 97.43 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 175.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 91.3 mt -61.87 -27.82 69.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.607 177.424 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . 0.464 ' HD3' ' HA ' ' A' ' 122' ' ' LYS . 64.0 mmtt -110.03 18.34 20.14 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 112.379 0.511 . . . . 0.0 112.379 179.262 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 80.2 p -79.77 147.72 31.74 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 171.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -55.22 -29.87 58.83 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 121.066 0.46 . . . . 0.0 110.39 176.516 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.443 ' O ' ' HG ' ' A' ' 129' ' ' LEU . 2.1 mp -60.19 -57.72 10.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.482 179.4 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 72.9 t80 -65.52 -39.34 91.71 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.664 -177.486 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -63.77 -33.41 75.59 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.854 178.136 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . 0.709 ' HA ' ' HA3' ' A' ' 132' ' ' GLY . 34.9 t70 -67.83 -34.53 76.9 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.065 0.459 . . . . 0.0 110.288 176.971 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.614 HD11 HG12 ' A' ' 3' ' ' VAL . 73.3 mt -76.41 -17.53 59.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.451 178.159 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' MET . . . . . 0.475 ' HE2' ' HB1' ' A' ' 8' ' ' ALA . 0.0 OUTLIER -91.3 -74.29 0.51 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.829 178.493 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -146.21 34.41 0.99 Allowed 'General case' 0 C--O 1.236 0.361 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.58 -175.75 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . 0.709 ' HA3' ' HA ' ' A' ' 128' ' ' ASP . . . -74.36 -104.7 0.09 OUTLIER Glycine 0 C--N 1.331 0.27 0 C-N-CA 120.993 -0.622 . . . . 0.0 112.296 -179.505 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . 0.472 ' NH2' ' HB2' ' A' ' 128' ' ' ASP . 0.1 OUTLIER -97.67 114.57 65.13 Favored Pre-proline 0 CA--C 1.532 0.28 0 O-C-N 122.761 -0.258 . . . . 0.0 110.388 -179.976 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo . . . . . 0 C--N 1.35 0.621 0 C-N-CA 122.47 2.113 . . . . 0.0 111.708 179.021 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 29.1 m . . . . . 0 N--CA 1.475 0.779 0 N-CA-C 110.835 -0.061 . . . . 0.0 110.835 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 67.9 mtm 64.64 -72.08 0.07 Allowed 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 122.926 0.49 . . . . 0.0 110.014 -173.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . 0.466 HG22 ' HB3' ' A' ' 7' ' ' GLU . 4.0 p -124.38 142.58 40.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.761 175.714 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 16.8 m -104.37 150.94 38.99 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 116.245 -0.434 . . . . 0.0 109.938 -179.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo -45.95 -31.78 8.7 Favored 'Trans proline' 0 C--N 1.353 0.797 0 C-N-CA 123.325 2.684 . . . . 0.0 112.667 178.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.445 ' O ' ' HD3' ' A' ' 10' ' ' LYS . 9.1 tp10 -55.74 -52.52 63.63 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-O 121.343 0.592 . . . . 0.0 110.144 175.649 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.466 ' HB3' HG22 ' A' ' 3' ' ' VAL . 9.5 tp10 -69.23 -32.67 72.07 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.727 -0.669 . . . . 0.0 109.967 179.04 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.66 -46.64 87.27 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.073 -179.348 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.404 HG23 ' O ' ' A' ' 6' ' ' GLU . 32.2 m -67.83 -27.93 39.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.313 0 CA-C-O 120.824 0.345 . . . . 0.0 110.198 179.167 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.445 ' HD3' ' O ' ' A' ' 6' ' ' GLU . 13.9 mptt -69.25 -36.52 77.25 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.027 173.244 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 49.7 m0 -60.83 -36.82 80.08 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 172.05 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -70.58 2.26 16.99 Favored Glycine 0 CA--C 1.521 0.418 0 CA-C-N 114.91 -1.041 . . . . 0.0 113.711 -177.063 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.408 ' HG3' ' O ' ' A' ' 10' ' ' LYS . 2.8 pp20? -127.74 -3.09 5.96 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 117.394 0.597 . . . . 0.0 111.499 177.326 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 74.0 m -153.34 105.78 2.89 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 120.667 0.27 . . . . 0.0 111.005 177.781 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.414 ' O ' ' HB3' ' A' ' 18' ' ' LEU . 30.9 t80 -58.33 -36.77 73.9 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 121.031 0.443 . . . . 0.0 109.932 178.292 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -57.43 -45.41 84.7 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.03 176.48 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.404 ' HB2' ' HE3' ' A' ' 17' ' ' LYS . 37.5 ttmt -65.07 -36.47 84.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.975 -178.513 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.414 ' HB3' ' O ' ' A' ' 15' ' ' PHE . 36.0 tp -59.73 -51.49 69.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.671 175.305 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 21.4 tp -80.49 -24.05 39.72 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.786 -171.704 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 70.7 m -69.57 -27.02 64.77 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.072 0.463 . . . . 0.0 110.629 178.11 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -80.15 129.73 34.71 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.568 174.067 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 10.6 tpt180 -59.47 -32.99 70.76 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 174.4 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -57.57 -50.82 71.85 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.536 176.655 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -70.78 -41.3 63.62 Favored Glycine 0 N--CA 1.449 -0.46 0 CA-C-N 115.014 -0.993 . . . . 0.0 112.217 -177.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 9.6 tt -60.21 -47.34 86.38 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 122.783 0.433 . . . . 0.0 110.226 179.572 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.593 ' O ' ' HG2' ' A' ' 30' ' ' ARG . 9.3 tp10 -65.09 -49.35 70.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.827 -179.339 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -59.74 -42.11 92.42 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.071 -179.646 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 76.9 t80 -68.64 -48.38 64.19 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.059 -176.449 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.424 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 14.6 t -60.53 -36.01 77.36 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 120.695 0.283 . . . . 0.0 110.544 -177.403 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.593 ' HG2' ' O ' ' A' ' 26' ' ' GLU . 21.6 mmt180 -62.53 -52.8 62.01 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.025 0.441 . . . . 0.0 110.326 178.735 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.558 ' O ' HG23 ' A' ' 34' ' ' THR . 84.5 t80 -65.31 -31.03 71.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.609 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 17.7 tp -74.03 -26.77 60.61 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.435 -179.199 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.424 ' HG3' ' O ' ' A' ' 29' ' ' THR . 67.3 mttm -76.95 -34.77 57.59 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.26 178.839 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.558 HG23 ' O ' ' A' ' 31' ' ' PHE . 7.2 t -71.17 -8.52 54.05 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.785 0.326 . . . . 0.0 111.095 -177.013 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -119.24 17.34 13.13 Favored 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 173.142 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 33.4 p90 43.41 29.94 0.28 Allowed 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.171 0.988 . . . . 0.0 112.822 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 31.5 m -95.63 8.88 42.13 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.184 176.375 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -56.8 -21.06 25.93 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.066 -179.205 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.427 ' HG3' ' N ' ' A' ' 40' ' ' ASN . 8.9 pt-20 -49.62 -37.24 27.21 Favored 'General case' 0 C--O 1.225 -0.216 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.271 177.628 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.427 ' N ' ' HG3' ' A' ' 39' ' ' GLU . 46.9 m-80 -60.77 -61.31 2.68 Favored 'General case' 0 C--O 1.24 0.605 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.803 -174.215 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 13.0 tt -64.47 -34.02 66.75 Favored 'Isoleucine or valine' 0 C--O 1.235 0.309 0 CA-C-O 121.053 0.454 . . . . 0.0 110.019 -177.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.465 ' O ' HG21 ' A' ' 45' ' ' ILE . 6.3 tp10 -72.74 -25.94 61.39 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.166 -179.309 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.419 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 71.9 t80 -64.63 -65.1 0.72 Allowed 'General case' 0 C--O 1.236 0.384 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.713 179.136 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 32.6 p-90 -78.08 -9.72 59.28 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 119.747 -0.781 . . . . 0.0 112.385 -173.364 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.602 ' O ' ' HG3' ' A' ' 48' ' ' GLU . 9.5 tt -75.17 -31.54 24.76 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.201 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 169.502 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.28 -29.31 69.51 Favored 'General case' 0 C--O 1.232 0.137 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 172.472 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.558 ' SG ' ' HB2' ' A' ' 101' ' ' PHE . 52.7 t -66.22 -32.73 74.33 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.349 176.309 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.605 ' O ' ' HG2' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -82.91 -28.79 29.69 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 177.379 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.432 ' O ' ' HB2' ' A' ' 52' ' ' LYS . 15.6 t70 -58.41 -27.61 64.45 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.742 0.782 . . . . 0.0 109.094 167.386 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.494 ' HB3' ' O ' ' A' ' 47' ' ' CYS . 42.4 t80 -79.3 -30.11 42.75 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 114.87 -1.059 . . . . 0.0 111.211 175.416 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.605 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 10.0 ptmt -60.74 -22.79 64.38 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 174.792 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.432 ' HB2' ' O ' ' A' ' 49' ' ' ASP . 14.0 mptt -72.47 56.79 0.37 Allowed 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.311 168.661 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 48.1 t -141.7 94.04 2.63 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.939 0.4 . . . . 0.0 109.939 175.159 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.63 -6.88 59.56 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.836 -179.757 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -106.8 123.19 7.24 Favored Glycine 0 CA--C 1.519 0.302 0 CA-C-O 119.735 -0.48 . . . . 0.0 111.916 -179.597 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_exo -56.39 -26.56 63.28 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.721 2.28 . . . . 0.0 112.507 179.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 30.5 mm-40 -71.49 -45.46 62.45 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 174.458 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 75.3 mm-40 -59.23 -31.75 69.35 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.06 179.342 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 37.2 mm -50.9 -54.43 10.26 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.115 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.614 176.099 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 37.5 m-70 -65.86 -36.5 83.62 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.84 -177.67 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 83.4 mt -68.73 -51.77 37.8 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.458 -176.459 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 52.2 mtpt -71.39 -31.45 67.3 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.413 -177.65 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.72 -42.01 87.01 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 120.968 0.413 . . . . 0.0 110.06 174.415 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 22.5 tptp -59.52 -35.2 73.72 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.097 176.431 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -65.03 -57.2 9.27 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.584 176.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 65.3 mt -58.64 -33.33 48.43 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 CA-C-O 121.204 0.526 . . . . 0.0 110.337 179.209 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.509 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 50.5 t80 -55.86 -61.9 2.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.449 177.426 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -71.25 -31.27 67.33 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.728 -174.732 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -82.79 -25.4 32.79 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.755 -174.491 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 85.7 m-85 -133.56 -53.74 0.88 Allowed 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -174.608 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.509 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 50.0 mm -70.72 -29.54 38.39 Favored 'Isoleucine or valine' 0 C--O 1.238 0.492 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 -170.471 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -64.63 143.29 58.03 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.018 -173.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.8 m -63.19 -39.56 95.0 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.06 178.263 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -101.24 92.51 5.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.538 0.685 . . . . 0.0 109.708 172.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.497 ' HB3' ' HD2' ' A' ' 76' ' ' PRO . . . -123.27 161.33 45.82 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.2 -176.312 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.497 ' HD2' ' HB3' ' A' ' 75' ' ' ALA . 4.1 Cg_endo -45.63 -37.37 15.49 Favored 'Trans proline' 0 C--N 1.356 0.958 0 C-N-CA 123.451 2.767 . . . . 0.0 113.02 -178.143 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 8.7 ttpp -139.93 -3.43 1.43 Allowed 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.615 -0.266 . . . . 0.0 111.081 176.6 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.49 ' HA ' ' HB1' ' A' ' 75' ' ' ALA . 54.8 mt-10 60.94 157.27 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 121.457 0.646 . . . . 0.0 111.92 -176.138 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 68.0 t -119.94 144.84 27.34 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.494 175.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 39.1 m-80 -81.59 19.93 0.97 Allowed 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 111.981 0.363 . . . . 0.0 111.981 -176.109 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 28.0 tp -65.77 140.39 58.42 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 175.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.406 ' OD2' ' HB3' ' A' ' 84' ' ' HIS . 8.4 p-10 -64.29 156.66 28.26 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.139 0.495 . . . . 0.0 112.098 -171.749 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.403 ' HA ' ' HG2' ' A' ' 86' ' ' LYS . 96.8 m-85 -60.07 -40.43 89.47 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.059 -178.514 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . 0.457 ' O ' HG23 ' A' ' 88' ' ' VAL . 24.0 t60 -53.61 -56.3 18.34 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.314 -179.175 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.429 ' OG1' ' HG3' ' A' ' 107' ' ' ARG . 29.2 m -72.06 -42.41 66.27 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.856 -174.588 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.663 ' HB2' ' HZ1' ' A' ' 86' ' ' LYS . 0.1 OUTLIER -65.76 -31.85 73.07 Favored 'General case' 0 N--CA 1.463 0.181 0 C-N-CA 120.753 -0.379 . . . . 0.0 110.203 -178.985 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -62.54 -47.93 81.73 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.328 0.585 . . . . 0.0 109.947 177.242 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.457 HG23 ' O ' ' A' ' 84' ' ' HIS . 98.1 t -53.7 -46.3 61.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.554 178.687 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 56.9 mt -72.42 -40.9 64.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.535 -176.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 22.0 p -62.87 -21.67 66.14 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.788 0.327 . . . . 0.0 111.25 -178.372 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 35.4 m-80 -96.46 -38.6 9.95 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.094 176.146 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 16.8 t -83.35 0.06 47.6 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.596 -0.274 . . . . 0.0 111.468 -175.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 8.0 tp -57.38 -26.59 26.59 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 CA-C-O 120.866 0.365 . . . . 0.0 111.628 -178.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.405 HG21 ' HG2' ' A' ' 95' ' ' GLN . 9.9 t -66.45 -28.2 68.42 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 120.978 0.418 . . . . 0.0 110.984 179.313 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.405 ' HG2' HG21 ' A' ' 94' ' ' THR . 22.7 pt20 -139.21 71.45 40.01 Favored Pre-proline 0 CA--C 1.534 0.355 0 CA-C-O 121.129 0.49 . . . . 0.0 110.548 -178.736 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -87.6 131.78 2.91 Favored 'Trans proline' 0 N--CA 1.459 -0.523 0 C-N-CA 122.735 2.29 . . . . 0.0 112.477 -178.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' THR . . . . . 0.462 ' N ' ' HB2' ' A' ' 100' ' ' SER . 37.9 p -83.52 171.77 13.04 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.411 174.59 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 36.9 tp -61.02 -26.03 67.32 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 121.266 0.555 . . . . 0.0 110.526 -178.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . 0.557 ' HB3' ' HB2' ' A' ' 102' ' ' ASP . 23.3 m-70 -119.74 34.37 5.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.522 177.171 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' SER . . . . . 0.462 ' HB2' ' N ' ' A' ' 97' ' ' THR . 22.2 t -61.74 -31.81 72.01 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.32 177.337 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.558 ' HB2' ' SG ' ' A' ' 47' ' ' CYS . 88.0 m-85 -91.9 6.36 46.5 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.966 -178.77 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . 0.557 ' HB2' ' HB3' ' A' ' 99' ' ' HIS . 12.8 t70 -64.11 -41.65 97.17 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.117 0.484 . . . . 0.0 110.347 -177.178 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.433 ' O ' ' HG2' ' A' ' 107' ' ' ARG . . . -59.32 -43.3 92.68 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.179 176.254 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.0 -37.41 85.84 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.413 177.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 21.5 tm0? -57.86 -45.38 86.4 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.169 176.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' SER . . . . . 0.66 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 47.7 t -60.15 -58.44 8.53 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.527 -0.761 . . . . 0.0 110.165 176.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . 0.435 ' O ' ' HG ' ' A' ' 111' ' ' LEU . 23.2 mmm180 -49.22 -55.42 12.62 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 120.945 0.402 . . . . 0.0 111.336 -177.864 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 74.6 t -57.44 -40.03 72.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.026 179.444 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . 0.504 ' HA ' ' HE3' ' A' ' 112' ' ' MET . 55.6 t80 -64.26 -37.35 87.16 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.772 178.714 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.66 ' HG3' ' O ' ' A' ' 106' ' ' SER . 42.7 mt-30 -67.56 -42.1 83.15 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 178.24 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.435 ' HG ' ' O ' ' A' ' 107' ' ' ARG . 93.4 mt -59.71 -45.02 93.42 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.819 -1.082 . . . . 0.0 110.679 -179.171 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' MET . . . . . 0.504 ' HE3' ' HA ' ' A' ' 109' ' ' TYR . 54.5 mtm -62.08 -41.34 98.07 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 176.811 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . 0.619 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 4.5 tm-20 -61.92 -71.03 0.16 Allowed 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.913 -176.169 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -57.69 -18.13 19.01 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -171.487 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . 0.45 ' O ' ' HD3' ' A' ' 119' ' ' ARG . 7.8 m-20 -118.26 -75.99 0.58 Allowed 'General case' 0 N--CA 1.463 0.201 0 N-CA-C 111.576 0.213 . . . . 0.0 111.576 179.075 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 17.6 m -58.56 -28.37 65.46 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -171.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . 0.619 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 68.4 t80 -78.11 -45.32 23.71 Favored 'General case' 0 C--N 1.333 -0.123 0 N-CA-C 110.694 -0.113 . . . . 0.0 110.694 -176.825 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' THR . . . . . 0.521 HG22 ' HD2' ' A' ' 119' ' ' ARG . 11.5 t -66.62 -40.22 88.68 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-O 120.918 0.389 . . . . 0.0 110.151 178.294 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . 0.521 ' HD2' HG22 ' A' ' 118' ' ' THR . 3.1 mpt_? -61.53 -38.66 88.22 Favored 'General case' 0 N--CA 1.461 0.104 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 173.754 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.488 ' HA ' ' HB3' ' A' ' 123' ' ' SER . 76.8 t80 -64.7 -36.16 83.39 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.322 177.38 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.47 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 89.9 mt -59.76 -28.99 67.87 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.646 0.26 . . . . 0.0 110.576 178.035 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . 0.451 ' HD3' ' HA ' ' A' ' 122' ' ' LYS . 31.1 mmtp -115.1 16.9 16.97 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 176.121 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' SER . . . . . 0.488 ' HB3' ' HA ' ' A' ' 120' ' ' PHE . 83.6 p -70.42 141.48 52.12 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 173.408 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -55.88 -38.14 69.75 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.243 -178.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.467 ' O ' ' HG ' ' A' ' 129' ' ' LEU . 7.7 tp -65.09 -42.86 95.54 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.147 -179.318 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 73.6 t80 -69.62 -36.97 76.64 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.743 0.306 . . . . 0.0 110.684 -179.609 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 94.4 mt -66.39 -29.88 70.14 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 120.934 0.397 . . . . 0.0 110.019 177.3 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -65.53 -34.05 77.35 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.048 173.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 125' ' ' ILE . 55.2 mt -76.3 -29.95 57.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.592 177.325 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' MET . . . . . . . . . . . . . 4.7 mmt -63.82 -21.52 66.47 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 116.094 -0.503 . . . . 0.0 112.128 -179.451 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -97.15 -3.58 40.79 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.738 0.304 . . . . 0.0 110.628 178.573 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 59.58 59.58 10.32 Favored Glycine 0 C--N 1.334 0.433 0 N-CA-C 111.393 -0.683 . . . . 0.0 111.393 -176.567 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . 0.4 HH11 ' HD2' ' A' ' 133' ' ' ARG . 21.1 ttt180 -43.87 115.55 2.11 Favored Pre-proline 0 C--O 1.238 0.483 0 C-N-CA 123.265 0.626 . . . . 0.0 112.393 -174.876 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo . . . . . 0 C--N 1.349 0.578 0 C-N-CA 122.523 2.148 . . . . 0.0 111.257 176.371 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 28.7 t . . . . . 0 N--CA 1.478 0.953 0 N-CA-C 110.133 -0.321 . . . . 0.0 110.133 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 15.6 tpt 61.61 89.94 0.07 Allowed 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.464 0.65 . . . . 0.0 110.213 -175.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . 0.444 HG11 ' CH2' ' A' ' 11' ' ' TRP . 8.6 p -78.19 160.78 4.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.494 -174.101 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 36.9 m -66.06 132.06 94.56 Favored Pre-proline 0 CA--C 1.534 0.363 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.889 172.602 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_exo -49.14 -33.98 29.06 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 123.159 2.573 . . . . 0.0 113.433 -176.012 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.494 ' O ' ' HG2' ' A' ' 10' ' ' LYS . 42.1 mt-10 -61.76 -45.61 93.17 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-O 120.809 0.337 . . . . 0.0 110.803 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.403 ' O ' ' HB2' ' A' ' 10' ' ' LYS . 17.4 tp10 -70.22 -33.38 71.6 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.155 0.502 . . . . 0.0 109.7 177.814 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.21 -45.5 92.98 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.804 179.124 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 30.7 m -75.02 -19.06 16.28 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-O 120.758 0.313 . . . . 0.0 110.837 179.486 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.494 ' HG2' ' O ' ' A' ' 6' ' ' GLU . 72.0 mmtt -67.06 -29.1 68.79 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.513 173.274 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . 0.444 ' CH2' HG11 ' A' ' 3' ' ' VAL . 54.2 m0 -62.08 -24.11 66.91 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.074 -179.28 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -65.59 -12.07 55.26 Favored Glycine 0 CA--C 1.521 0.424 0 C-N-CA 121.173 -0.537 . . . . 0.0 112.593 177.325 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -74.71 -49.67 20.31 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 120.718 0.294 . . . . 0.0 110.611 177.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 30.5 m -154.19 128.76 9.26 Favored 'General case' 0 C--O 1.24 0.575 0 CA-C-O 121.024 0.44 . . . . 0.0 111.639 -175.127 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.443 ' CD1' HD22 ' A' ' 18' ' ' LEU . 84.8 t80 -55.55 -26.84 45.55 Favored 'General case' 0 N--CA 1.461 0.111 0 CA-C-N 115.641 -0.708 . . . . 0.0 109.931 175.141 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -51.89 -55.39 20.43 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.377 -0.828 . . . . 0.0 111.168 177.243 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.471 ' HD2' ' O ' ' A' ' 10' ' ' LYS . 17.3 ptpt -71.94 -30.42 65.3 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 120.927 -0.309 . . . . 0.0 110.363 -176.616 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.443 HD22 ' CD1' ' A' ' 15' ' ' PHE . 51.6 tp -56.32 -51.93 66.43 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.068 -0.514 . . . . 0.0 109.98 175.052 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 51.4 tp -71.19 -35.26 71.51 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.86 -178.138 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.0 m -74.3 -22.26 59.36 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.878 -177.103 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.9 t-80 -90.61 117.66 29.45 Favored 'General case' 0 N--CA 1.462 0.134 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 -179.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.461 ' HD3' ' H ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -36.68 -53.46 0.9 Allowed 'General case' 0 N--CA 1.475 0.817 0 O-C-N 123.847 0.717 . . . . 0.0 111.852 -176.682 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -56.93 -45.36 82.8 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.77 -177.454 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -65.95 -44.64 91.31 Favored Glycine 0 C--N 1.333 0.372 0 CA-C-N 115.727 -0.669 . . . . 0.0 111.791 -179.198 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 8.0 tt -57.9 -44.84 87.03 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.888 0.375 . . . . 0.0 110.299 177.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -64.33 -46.43 83.54 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.555 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -63.76 -35.41 80.49 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 120.999 0.428 . . . . 0.0 110.504 179.597 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -71.0 -49.51 44.45 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.419 -0.809 . . . . 0.0 110.956 -176.393 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 9.1 t -62.86 -36.12 82.24 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 120.656 0.265 . . . . 0.0 110.704 -178.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 74.6 mtm180 -64.92 -38.94 92.63 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 120.731 0.3 . . . . 0.0 111.104 179.661 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.557 ' O ' HG21 ' A' ' 34' ' ' THR . 87.0 t80 -76.55 -50.69 13.3 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.055 0.455 . . . . 0.0 110.553 178.789 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 36.8 tp -58.36 -24.95 61.37 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.011 -178.495 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 24.0 ttmm -63.75 -33.22 75.16 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.599 -178.665 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.557 HG21 ' O ' ' A' ' 31' ' ' PHE . 6.2 t -68.82 -20.51 64.31 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 121.183 -0.207 . . . . 0.0 111.457 -174.966 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -105.03 -1.5 25.61 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.806 0.336 . . . . 0.0 110.463 177.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 61.62 18.99 10.05 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 115.734 -0.666 . . . . 0.0 112.306 175.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.3 m -84.05 2.92 36.9 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 121.077 0.465 . . . . 0.0 109.955 176.157 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -51.65 -21.99 3.07 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.252 -0.886 . . . . 0.0 112.709 -177.46 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.472 ' CD ' ' HZ2' ' A' ' 77' ' ' LYS . 26.1 mt-10 -58.61 -17.27 20.69 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -176.663 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.446 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 20.7 p30 -67.78 -39.44 84.08 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 121.269 0.557 . . . . 0.0 110.044 175.329 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.449 ' HA ' ' CZ2' ' A' ' 44' ' ' TRP . 58.6 mt -65.53 -47.34 86.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.68 175.406 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.426 ' HA ' HG21 ' A' ' 45' ' ' ILE . 2.8 mp0 -64.51 -24.0 67.46 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.931 176.239 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.446 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 60.3 t80 -61.58 -62.91 1.48 Allowed 'General case' 0 C--O 1.237 0.445 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.464 179.728 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.449 ' CZ2' ' HA ' ' A' ' 41' ' ' ILE . 3.6 p-90 -82.78 -7.81 59.63 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 120.292 -0.563 . . . . 0.0 112.422 -177.678 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.426 HG21 ' HA ' ' A' ' 42' ' ' GLU . 5.5 tt -76.9 -30.37 18.2 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 171.377 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.25 -35.5 71.43 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.735 173.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.404 ' O ' ' HB3' ' A' ' 50' ' ' PHE . 71.3 m -63.88 -33.74 76.38 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.12 174.524 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.599 ' O ' ' HG3' ' A' ' 52' ' ' LYS . 3.5 tm-20 -63.59 -51.24 66.19 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 108.434 -0.951 . . . . 0.0 108.434 173.109 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.542 ' HA ' ' CD ' ' A' ' 52' ' ' LYS . 27.5 t70 -50.36 -31.98 16.12 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.601 176.447 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.404 ' HB3' ' O ' ' A' ' 47' ' ' CYS . 78.9 t80 -70.51 -43.82 68.87 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.548 -178.578 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.566 ' HE3' ' HG2' ' A' ' 48' ' ' GLU . 18.6 pttp -69.13 -16.58 63.69 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 120.89 0.376 . . . . 0.0 110.823 -177.502 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.599 ' HG3' ' O ' ' A' ' 48' ' ' GLU . 15.8 mtpp -75.78 -14.02 60.3 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.256 178.739 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 79.4 p -58.22 -47.83 82.27 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.254 -175.669 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 46.91 18.57 0.07 Allowed 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.285 1.034 . . . . 0.0 112.769 -179.413 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . 0.458 ' O ' HG12 ' A' ' 59' ' ' ILE . . . -129.89 123.34 4.02 Favored Glycine 0 C--N 1.331 0.251 0 N-CA-C 111.313 -0.715 . . . . 0.0 111.313 -179.121 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -48.9 -52.16 9.18 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 123.378 2.719 . . . . 0.0 112.851 -173.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 27.2 pt20 -63.17 -39.46 94.71 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 120.717 0.294 . . . . 0.0 111.085 -179.214 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -68.47 -26.51 65.52 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.395 -178.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.458 HG12 ' O ' ' A' ' 55' ' ' GLY . 38.4 mm -55.91 -49.81 72.78 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.213 0 CA-C-O 121.07 0.462 . . . . 0.0 110.169 175.36 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 63.4 m-70 -64.92 -35.29 80.69 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.375 -177.409 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 93.8 mt -73.13 -54.32 8.79 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.518 -176.364 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 32.4 mmtp -63.74 -35.67 81.36 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.539 0.209 . . . . 0.0 110.785 -179.459 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.47 -48.82 80.1 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.189 176.499 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 17.9 tppt? -57.26 -40.42 77.66 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.611 177.266 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.53 -64.05 1.08 Allowed 'General case' 0 C--O 1.234 0.238 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.795 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 64.7 mt -56.39 -36.82 48.32 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 CA-C-O 121.14 0.495 . . . . 0.0 110.542 -179.463 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.459 ' CE1' HG21 ' A' ' 90' ' ' THR . 8.3 t80 -54.55 -73.94 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.348 -179.791 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -75.68 -3.55 35.28 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 -172.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.5 tppt? -95.18 -34.89 12.08 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 120.981 -0.288 . . . . 0.0 110.677 177.654 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 72.8 m-85 -130.93 -52.74 1.05 Allowed 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -173.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.428 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 46.4 mm -61.0 -44.19 97.69 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 CA-C-O 121.146 0.498 . . . . 0.0 111.388 -171.883 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -69.12 135.35 50.59 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.606 -175.032 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 22.1 m -70.11 -31.88 69.64 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.541 0.686 . . . . 0.0 109.353 176.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -83.74 13.26 4.9 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.151 -0.931 . . . . 0.0 110.816 176.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.556 ' HB3' ' HD2' ' A' ' 76' ' ' PRO . . . -63.76 160.21 47.13 Favored Pre-proline 0 CA--C 1.532 0.286 0 CA-C-N 116.394 -0.367 . . . . 0.0 110.133 176.118 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . 0.556 ' HD2' ' HB3' ' A' ' 75' ' ' ALA . 8.7 Cg_endo -50.27 -30.07 25.09 Favored 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 123.005 2.47 . . . . 0.0 113.164 -174.935 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.502 ' HD2' ' O ' ' A' ' 78' ' ' GLU . 0.1 OUTLIER -146.1 8.47 1.08 Allowed 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 120.639 0.257 . . . . 0.0 111.155 177.781 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 0.538 ' HA ' ' HB1' ' A' ' 75' ' ' ALA . 9.8 pt-20 45.01 -172.98 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 124.715 1.206 . . . . 0.0 114.022 -179.871 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 54.3 t -153.99 139.54 11.02 Favored 'Isoleucine or valine' 0 C--O 1.237 0.408 0 CA-C-N 114.812 -1.086 . . . . 0.0 108.173 178.203 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 -70.39 88.04 0.64 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.637 0.732 . . . . 0.0 111.082 -179.074 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 14.0 tp -133.91 145.0 49.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 114.751 -1.113 . . . . 0.0 109.175 178.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -54.12 142.15 26.47 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 121.299 0.571 . . . . 0.0 112.256 -176.168 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 40.8 p90 -66.5 -43.51 85.13 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.109 -0.95 . . . . 0.0 111.789 -176.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . 0.408 ' O ' ' HB3' ' A' ' 87' ' ' GLU . 85.2 t60 -70.37 -30.41 67.33 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.109 0.481 . . . . 0.0 110.461 -175.854 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 47.3 m -64.82 -52.15 58.28 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.285 177.666 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.449 ' O ' HG23 ' A' ' 90' ' ' THR . 18.0 ptpt -70.64 -24.04 62.64 Favored 'General case' 0 C--O 1.226 -0.164 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.623 -178.697 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.408 ' HB3' ' O ' ' A' ' 84' ' ' HIS . 12.0 tp10 -54.17 -58.73 6.24 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-O 121.448 0.642 . . . . 0.0 110.014 173.406 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 61.4 t -56.09 -42.26 71.81 Favored 'Isoleucine or valine' 0 C--O 1.237 0.44 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.303 178.458 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 70.1 mt -60.71 -47.36 93.4 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.248 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.207 -179.231 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.459 HG21 ' CE1' ' A' ' 67' ' ' TYR . 60.3 p -59.57 -30.56 68.73 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 121.037 0.446 . . . . 0.0 110.8 -177.599 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 -87.01 -17.29 33.34 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 115.817 -0.629 . . . . 0.0 112.26 -175.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 43.3 p -121.66 3.6 10.11 Favored 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 -179.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.6 tp -61.53 -23.51 30.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 CA-C-O 120.776 0.322 . . . . 0.0 111.631 -175.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.41 HG22 ' HG3' ' A' ' 95' ' ' GLN . 9.7 t -67.28 -32.97 74.32 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.131 -178.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.41 ' HG3' HG22 ' A' ' 94' ' ' THR . 96.4 mt-30 -136.33 75.58 52.04 Favored Pre-proline 0 N--CA 1.464 0.274 0 N-CA-C 110.321 -0.251 . . . . 0.0 110.321 -178.603 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -92.76 176.45 1.62 Allowed 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 122.82 2.346 . . . . 0.0 112.713 179.13 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 75.4 p -117.31 178.28 4.43 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.426 175.519 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -57.19 -24.94 57.89 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 112.154 0.427 . . . . 0.0 112.154 -173.36 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 93.8 m-70 -138.93 31.17 2.22 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 112.365 0.506 . . . . 0.0 112.365 -177.024 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 66.0 m -62.08 -21.57 65.06 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 121.078 0.465 . . . . 0.0 110.941 175.221 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -81.82 8.2 10.83 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.374 -179.676 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -60.79 -37.99 83.8 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 120.629 0.252 . . . . 0.0 110.479 -177.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.45 -43.23 99.22 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.661 177.499 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.34 -46.54 79.82 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.507 179.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.442 ' HG2' ' HB3' ' A' ' 44' ' ' TRP . 46.4 mt-30 -60.29 -41.81 94.16 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.007 177.719 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' SER . . . . . 0.671 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 45.7 t -55.82 -58.49 7.64 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.851 178.238 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 2.5 mmp_? -46.98 -59.05 3.37 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.584 -178.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.527 ' O ' ' HG3' ' A' ' 112' ' ' MET . 11.4 p -64.7 -33.35 62.7 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.552 -175.862 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . 0.504 ' HA ' ' HE1' ' A' ' 112' ' ' MET . 15.8 t80 -66.5 -43.54 85.02 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.2 -179.521 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.671 ' HG3' ' O ' ' A' ' 106' ' ' SER . 31.1 mt-30 -62.7 -40.3 96.72 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 121.666 0.746 . . . . 0.0 109.014 177.599 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 89.7 mt -60.63 -41.0 94.01 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.531 -1.213 . . . . 0.0 110.415 176.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' MET . . . . . 0.527 ' HG3' ' O ' ' A' ' 108' ' ' VAL . 46.2 mtm -60.87 -39.66 90.01 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 177.338 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . 0.58 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 43.9 tt0 -61.42 -65.97 0.61 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.918 0.39 . . . . 0.0 110.208 179.104 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . 0.406 ' HG2' ' O ' ' A' ' 110' ' ' GLN . 10.7 pt20 -75.07 16.0 0.36 Allowed 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -172.843 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -141.99 -65.44 0.42 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.724 0.297 . . . . 0.0 110.686 173.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 4.2 m -68.21 -38.35 81.82 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.391 -176.351 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . 0.58 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 36.1 t80 -71.51 -40.83 69.88 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 110.285 -0.265 . . . . 0.0 110.285 -175.027 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 29.4 p -63.39 -43.56 97.23 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 120.921 0.391 . . . . 0.0 110.239 177.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 69.0 mtp85 -60.0 -40.49 89.4 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.003 174.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 58.3 t80 -66.58 -34.15 77.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.204 179.243 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.489 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 95.6 mt -65.27 -26.3 68.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.949 0.404 . . . . 0.0 110.249 175.562 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . 0.622 ' HE2' ' HA ' ' A' ' 122' ' ' LYS . 11.4 mmpt? -88.58 -16.44 32.52 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.335 179.263 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 59.1 p -61.66 139.9 58.24 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 120.99 0.424 . . . . 0.0 111.198 -177.161 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 16.6 p-10 -62.37 -31.31 71.95 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.814 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -64.43 -45.26 96.35 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.393 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' TYR . . . . . 0.443 ' O ' ' HG2' ' A' ' 130' ' ' MET . 69.5 t80 -69.12 -43.18 74.95 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 120.786 0.326 . . . . 0.0 110.333 -179.488 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 99.4 mt -60.42 -35.99 77.11 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.496 178.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -63.72 -38.99 93.2 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.347 177.215 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 91.8 mt -70.54 -27.52 64.22 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.986 179.263 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' MET . . . . . 0.459 ' HA ' ' HE1' ' A' ' 130' ' ' MET . 30.1 mmt -64.65 -63.51 1.11 Allowed 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.223 179.113 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 55.54 21.84 4.72 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.047 177.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 65.48 17.66 64.63 Favored Glycine 0 C--N 1.336 0.566 0 CA-C-N 116.061 -0.518 . . . . 0.0 113.201 -179.776 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 27.1 mmt180 -71.7 140.75 84.27 Favored Pre-proline 0 CA--C 1.533 0.295 0 CA-C-O 120.472 0.177 . . . . 0.0 110.852 -178.644 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo . . . . . 0 C--N 1.349 0.557 0 C-N-CA 122.766 2.311 . . . . 0.0 112.262 177.74 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 22.5 m . . . . . 0 N--CA 1.475 0.817 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 71.5 mtp 66.17 -176.01 0.19 Allowed 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.566 -177.403 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . 0.445 HG11 HD22 ' A' ' 129' ' ' LEU . 7.0 p -55.3 150.1 2.44 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 CA-C-N 115.179 -0.919 . . . . 0.0 112.749 -178.132 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 32.2 t -133.66 150.28 74.38 Favored Pre-proline 0 CA--C 1.534 0.351 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 173.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_exo -43.38 -40.74 10.05 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.905 2.404 . . . . 0.0 113.018 179.87 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.512 ' O ' ' HG2' ' A' ' 10' ' ' LYS . 37.6 tt0 -66.81 -39.55 87.76 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 121.146 0.498 . . . . 0.0 110.453 178.744 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -63.04 -35.84 81.57 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.232 0.539 . . . . 0.0 109.557 177.267 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.88 -45.2 93.66 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.553 -0.748 . . . . 0.0 111.346 -178.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.509 HG22 ' O ' ' A' ' 6' ' ' GLU . 24.6 m -67.56 -26.41 35.47 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.293 0 CA-C-O 120.765 0.317 . . . . 0.0 110.589 179.877 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.512 ' HG2' ' O ' ' A' ' 6' ' ' GLU . 74.3 mmtt -65.95 -29.5 69.92 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.263 0.554 . . . . 0.0 110.145 174.692 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 36.4 m0 -79.07 -30.07 43.75 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 174.321 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -69.64 -11.46 65.6 Favored Glycine 0 C--N 1.332 0.354 0 CA-C-N 115.286 -0.87 . . . . 0.0 112.65 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -106.83 -36.3 6.7 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 120.705 0.288 . . . . 0.0 110.778 175.547 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 46.4 t -123.85 105.5 9.69 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 120.905 0.383 . . . . 0.0 111.081 -176.184 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.403 ' O ' HD11 ' A' ' 19' ' ' LEU . 30.1 t80 -61.67 -33.64 74.34 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.995 177.391 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -61.15 -40.9 95.57 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.389 175.365 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.735 ' HB2' ' HZ3' ' A' ' 17' ' ' LYS . 4.1 ttmp? -69.75 -33.33 72.3 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.061 -178.457 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 67.6 tp -56.83 -48.52 77.84 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.029 173.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.403 HD11 ' O ' ' A' ' 15' ' ' PHE . 4.9 mp -76.0 -26.47 56.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.011 -179.619 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.0 t -72.92 -35.21 66.99 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.479 -178.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 -86.87 125.01 33.71 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.379 -0.601 . . . . 0.0 109.379 -178.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.427 ' O ' ' HB2' ' A' ' 26' ' ' GLU . 17.5 ttp180 -46.27 -47.27 18.2 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 122.87 0.468 . . . . 0.0 111.361 -178.283 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -58.59 -41.45 85.82 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.125 -179.172 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -67.09 -52.19 34.01 Favored Glycine 0 N--CA 1.449 -0.444 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.95 -177.434 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.1 tt -56.49 -40.94 75.81 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.091 0.472 . . . . 0.0 110.173 176.147 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.427 ' HB2' ' O ' ' A' ' 22' ' ' ARG . 1.1 tm-20 -59.04 -55.69 31.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.667 179.804 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.512 ' HA ' ' HD3' ' A' ' 30' ' ' ARG . . . -65.85 -39.29 90.61 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.8 -177.196 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -67.33 -40.94 85.96 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.919 -175.445 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 29.1 p -62.81 -45.01 94.61 Favored 'General case' 0 CA--C 1.529 0.147 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 178.238 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.512 ' HD3' ' HA ' ' A' ' 27' ' ' ALA . 53.0 mtp180 -54.23 -44.36 71.64 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.508 176.286 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.54 ' O ' HG22 ' A' ' 34' ' ' THR . 77.6 t80 -58.94 -48.2 82.34 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.756 178.542 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 14.2 tp -76.05 -10.9 59.79 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.012 -175.056 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -92.56 -9.87 39.64 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.552 177.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.54 HG22 ' O ' ' A' ' 31' ' ' PHE . 2.4 t -76.09 -15.57 60.07 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 121.517 0.675 . . . . 0.0 110.019 178.327 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.427 ' O ' ' N ' ' A' ' 37' ' ' SER . 7.9 pt-20 -145.9 90.58 1.99 Allowed 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 108.358 -0.978 . . . . 0.0 108.358 176.013 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 18.2 p90 -29.65 82.63 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 114.279 1.215 . . . . 0.0 114.279 -171.309 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.427 ' N ' ' O ' ' A' ' 35' ' ' GLU . 16.0 m -134.54 9.21 3.66 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 168.938 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -58.78 -32.13 69.02 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 114.1 -1.409 . . . . 0.0 111.603 -175.522 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.473 ' O ' ' HB2' ' A' ' 43' ' ' PHE . 5.1 mp0 -58.76 -20.21 47.52 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.645 -175.34 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.612 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 44.7 m-80 -75.81 -56.64 4.48 Favored 'General case' 0 C--O 1.241 0.646 0 CA-C-O 121.069 0.462 . . . . 0.0 111.092 -179.02 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.476 ' O ' HG13 ' A' ' 45' ' ' ILE . 10.0 tt -62.14 -43.84 98.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 179.511 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.574 ' HA ' ' HB ' ' A' ' 45' ' ' ILE . 52.1 mt-10 -72.75 -16.53 61.64 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.808 -179.009 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.612 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 66.5 t80 -61.27 -58.32 8.76 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 172.249 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.415 ' O ' ' HB3' ' A' ' 47' ' ' CYS . 37.1 p-90 -78.43 -15.21 58.9 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 119.404 -0.919 . . . . 0.0 111.493 -179.504 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.574 ' HB ' ' HA ' ' A' ' 42' ' ' GLU . 60.4 mt -69.03 -34.3 63.25 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.292 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 168.598 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.67 -31.84 73.13 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.965 -0.562 . . . . 0.0 109.784 173.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.42 ' O ' ' HB3' ' A' ' 50' ' ' PHE . 53.6 t -63.83 -33.6 76.05 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.587 173.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.442 ' HB3' ' O ' ' A' ' 45' ' ' ILE . 15.0 tp10 -66.16 -49.11 68.52 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 174.671 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.427 ' HA ' ' HG2' ' A' ' 52' ' ' LYS . 0.3 OUTLIER -66.66 -15.79 63.74 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.7 176.188 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.497 ' CZ ' HG22 ' A' ' 59' ' ' ILE . 92.7 t80 -78.44 -43.1 28.11 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.879 174.941 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.406 ' HD3' ' CE1' ' A' ' 99' ' ' HIS . 31.8 ttpt -61.13 -38.83 87.78 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.182 -179.359 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.427 ' HG2' ' HA ' ' A' ' 49' ' ' ASP . 21.9 ptmt -76.05 14.32 0.72 Allowed 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.665 -177.329 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.444 ' HB2' HD13 ' A' ' 59' ' ' ILE . 6.5 m -94.45 88.62 5.55 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 175.116 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.3 pptp? -74.27 -9.62 58.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.297 -177.186 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -91.19 118.52 5.43 Favored Glycine 0 N--CA 1.448 -0.505 0 N-CA-C 111.559 -0.617 . . . . 0.0 111.559 175.562 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.454 ' O ' ' HB ' ' A' ' 59' ' ' ILE . 19.3 Cg_endo -56.65 -30.33 83.24 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.847 2.365 . . . . 0.0 112.019 -176.991 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . 0.404 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 25.1 mt-30 -71.88 -45.32 61.72 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.916 -0.583 . . . . 0.0 109.858 177.805 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 50.9 tp60 -59.0 -33.13 70.36 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.848 179.256 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.497 HG22 ' CZ ' ' A' ' 50' ' ' PHE . 23.1 mm -55.24 -56.69 10.12 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.732 174.369 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 18.7 m-70 -59.73 -39.78 85.82 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.211 -176.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' A' ' 57' ' ' GLN . 94.6 mt -58.02 -59.61 5.01 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.387 -177.318 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 58.1 mtmt -72.4 -25.39 61.47 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.401 -176.475 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.61 -49.2 74.24 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 120.954 0.407 . . . . 0.0 110.579 176.711 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -63.83 -37.35 87.05 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.546 -179.207 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.9 -52.97 63.46 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.922 179.115 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 68.7 mt -63.53 -35.35 72.24 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.295 179.503 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.499 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 81.3 t80 -54.96 -63.9 1.01 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.7 177.884 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -63.55 -37.53 87.66 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.813 -173.713 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -81.52 -25.09 36.22 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.811 -173.462 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -130.37 -58.8 1.05 Allowed 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 -174.409 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.499 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 51.2 mm -66.81 -29.05 45.06 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -170.202 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -59.31 144.63 45.89 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.599 -177.506 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 16.9 p -61.63 -58.5 7.84 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.956 0.408 . . . . 0.0 109.928 176.824 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -87.59 85.8 7.13 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 172.083 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -117.03 153.09 49.5 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.932 -175.802 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -74.5 9.58 1.82 Allowed 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 122.811 2.341 . . . . 0.0 112.666 178.59 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.611 ' HE3' ' HA ' ' A' ' 77' ' ' LYS . 0.0 OUTLIER -137.61 -52.59 0.65 Allowed 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 122.457 0.303 . . . . 0.0 110.218 177.568 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 64.81 112.7 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.478 0 O-C-N 123.644 0.59 . . . . 0.0 111.301 -179.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.425 ' C ' ' H ' ' A' ' 81' ' ' LEU . 39.7 t -104.34 142.07 18.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.022 -0.535 . . . . 0.0 109.871 179.445 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -78.19 19.93 0.42 Allowed 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.992 0.425 . . . . 0.0 111.0 -180.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.425 ' H ' ' C ' ' A' ' 79' ' ' VAL . 28.4 tp -60.29 145.05 48.97 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.223 178.058 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -47.51 128.34 12.35 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.236 176.391 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -61.89 -37.1 83.32 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.93 -176.313 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . 0.423 ' O ' HG23 ' A' ' 88' ' ' VAL . 76.7 t60 -66.57 -35.85 81.23 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.664 0.268 . . . . 0.0 110.454 179.112 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 42.4 m -63.7 -44.43 93.7 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.128 0.489 . . . . 0.0 109.826 174.488 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.449 ' O ' HG23 ' A' ' 90' ' ' THR . 57.9 mtpt -62.38 -35.23 78.53 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.98 176.18 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -62.79 -45.08 94.3 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.793 179.738 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.423 HG23 ' O ' ' A' ' 84' ' ' HIS . 74.9 t -58.44 -43.08 85.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.072 0.463 . . . . 0.0 109.981 177.081 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 70.0 mt -68.65 -41.55 82.79 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.248 -177.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.449 HG23 ' O ' ' A' ' 86' ' ' LYS . 43.3 p -62.4 -29.74 70.7 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.837 0.351 . . . . 0.0 111.114 -178.505 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 -85.66 -35.99 20.57 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.032 178.138 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 32.6 t -87.04 -3.46 59.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.438 -0.347 . . . . 0.0 111.485 -176.609 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.1 tp -57.4 -32.3 40.93 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 N-CA-C 111.763 0.283 . . . . 0.0 111.763 -176.436 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 14.6 t -72.98 -31.19 64.37 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 120.739 0.304 . . . . 0.0 110.648 -178.718 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -142.4 79.11 15.9 Favored Pre-proline 0 C--O 1.233 0.19 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 177.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_endo -78.61 157.07 28.35 Favored 'Trans proline' 0 C--O 1.238 0.497 0 C-N-CA 122.614 2.21 . . . . 0.0 112.344 -177.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 41.2 p -85.15 179.69 7.19 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.422 177.224 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 41.0 tp -57.3 -34.23 68.49 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.607 -176.21 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . 0.533 ' O ' ' N ' ' A' ' 101' ' ' PHE . 41.9 m-70 -107.44 -28.75 9.64 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 119.622 -0.228 . . . . 0.0 111.15 177.09 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 47.1 t 52.06 -76.6 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 123.197 0.599 . . . . 0.0 111.694 178.102 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.533 ' N ' ' O ' ' A' ' 99' ' ' HIS . 34.7 m-85 -70.58 5.46 1.84 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.217 0.607 . . . . 0.0 110.981 179.542 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . 0.495 ' HB2' ' CB ' ' A' ' 99' ' ' HIS . 12.9 t70 -37.49 -54.49 1.13 Allowed 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.343 0.657 . . . . 0.0 112.249 174.595 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.45 -39.78 80.79 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 121.194 0.521 . . . . 0.0 110.771 -179.533 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.82 -30.73 69.34 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.635 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 21.7 tm0? -58.66 -51.27 70.66 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.623 178.181 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 22.2 m -59.72 -44.62 93.64 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.67 179.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . 0.436 ' O ' ' HG ' ' A' ' 111' ' ' LEU . 25.5 mmt180 -55.16 -62.58 1.57 Allowed 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.123 179.41 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 66.2 t -63.02 -37.53 79.6 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.119 -175.641 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 30.1 t80 -55.06 -53.3 57.57 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.966 179.223 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.409 ' HG3' ' O ' ' A' ' 107' ' ' ARG . 5.2 pp0? -71.6 -28.99 64.19 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 121.177 -0.209 . . . . 0.0 110.998 -176.896 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.436 ' HG ' ' O ' ' A' ' 107' ' ' ARG . 84.5 mt -60.17 -47.62 85.15 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 120.974 0.416 . . . . 0.0 110.219 175.632 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' MET . . . . . 0.444 ' SD ' ' HB ' ' A' ' 41' ' ' ILE . 36.9 mtm -69.56 -37.82 77.18 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.281 178.989 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . 0.637 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 40.2 tt0 -58.73 -61.92 2.25 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.695 -177.434 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -53.95 -28.54 37.99 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 -172.28 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -117.91 -61.92 1.62 Allowed 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 -176.19 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 9.2 m -64.7 -34.49 78.42 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.29 -0.414 . . . . 0.0 112.066 -173.583 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . 0.637 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 17.9 t80 -64.68 -54.45 31.41 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 120.442 0.163 . . . . 0.0 111.308 -175.503 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 14.2 t -61.65 -34.67 76.11 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.021 0.439 . . . . 0.0 110.435 -179.68 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 32.2 ttt180 -69.12 -37.41 78.33 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.864 179.103 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 82.8 t80 -60.0 -41.02 91.18 Favored 'General case' 0 C--N 1.334 -0.094 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.805 175.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 86.9 mt -61.84 -31.54 71.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.561 177.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 15.4 tptm -95.55 -2.65 48.05 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.689 -177.206 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 56.4 p -72.56 159.52 33.76 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 120.741 0.305 . . . . 0.0 110.888 -178.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -55.12 -34.4 63.68 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.106 175.061 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 68.6 mt -59.41 -53.68 44.82 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.231 -178.23 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 70.0 t80 -68.24 -38.96 82.38 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.656 0.265 . . . . 0.0 110.345 -177.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 93.0 mt -61.99 -32.59 73.07 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 120.882 0.372 . . . . 0.0 110.439 177.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -68.39 -35.98 78.48 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.971 176.055 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.445 HD22 HG11 ' A' ' 3' ' ' VAL . 94.0 mt -78.04 -11.93 59.95 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.013 178.899 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' MET . . . . . 0.625 ' HA ' ' HE3' ' A' ' 130' ' ' MET . 4.2 mmt -78.88 -72.31 0.39 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.867 178.748 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 40.21 24.79 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.02 0.928 . . . . 0.0 112.918 -176.413 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . -59.69 -61.0 7.71 Favored Glycine 0 C--N 1.335 0.478 0 C-N-CA 121.337 -0.458 . . . . 0.0 112.349 -176.753 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . 0.448 ' O ' ' HG3' ' A' ' 133' ' ' ARG . 24.9 ptt85 -138.39 88.75 14.47 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-O 121.209 0.528 . . . . 0.0 110.503 177.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo . . . . . 0 CA--C 1.531 0.35 0 C-N-CA 122.775 2.317 . . . . 0.0 111.415 176.524 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 47.7 t . . . . . 0 N--CA 1.478 0.931 0 CA-C-O 120.565 0.222 . . . . 0.0 110.956 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' MET . . . . . 0.429 ' C ' ' SD ' ' A' ' 2' ' ' MET . 0.3 OUTLIER -99.23 123.96 43.92 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 120.888 0.375 . . . . 0.0 110.579 -175.055 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . 0.443 HG21 ' CH2' ' A' ' 11' ' ' TRP . 3.1 p -156.92 141.35 8.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.362 179.051 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.0 p -103.36 148.77 36.21 Favored Pre-proline 0 C--N 1.327 -0.383 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 175.096 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_exo -51.78 -24.89 19.36 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 122.836 2.357 . . . . 0.0 112.617 178.355 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.05 -40.92 95.45 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.406 0.622 . . . . 0.0 109.5 176.102 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -74.0 -30.25 62.37 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.803 176.616 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.17 -52.68 61.42 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.727 178.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 27.0 m -65.1 -27.01 41.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.487 177.035 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.54 ' O ' ' HD2' ' A' ' 17' ' ' LYS . 5.0 tppt? -61.71 -46.5 89.41 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 175.84 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . 0.443 ' CH2' HG21 ' A' ' 3' ' ' VAL . 47.9 m0 -59.64 -28.81 67.56 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.44 177.507 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -60.3 -17.23 45.72 Favored Glycine 0 C--N 1.334 0.452 0 CA-C-N 115.602 -0.726 . . . . 0.0 112.465 177.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -76.22 -48.51 20.09 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 120.727 0.299 . . . . 0.0 110.952 177.622 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 38.8 m -146.35 121.71 10.29 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-O 121.064 0.459 . . . . 0.0 112.161 -172.23 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.405 ' O ' HD12 ' A' ' 19' ' ' LEU . 22.4 t80 -52.05 -28.38 17.11 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.093 174.303 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.443 ' HB2' ' HH ' ' A' ' 109' ' ' TYR . 10.4 t70 -54.27 -58.52 7.09 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.454 175.946 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.665 ' HB3' ' HZ3' ' A' ' 17' ' ' LYS . 0.4 OUTLIER -72.15 -16.77 61.98 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.849 -174.058 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 63.0 tp -65.85 -42.91 89.86 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 121.107 0.479 . . . . 0.0 109.764 171.316 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.405 HD12 ' O ' ' A' ' 15' ' ' PHE . 2.7 mp -78.63 -42.43 28.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.529 -176.713 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.549 ' OG ' ' HA ' ' A' ' 17' ' ' LYS . 12.7 p -65.91 -22.94 66.54 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 120.88 0.371 . . . . 0.0 111.091 -178.379 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -82.66 108.92 16.4 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 174.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.5 ptm180 -40.81 -37.33 0.75 Allowed 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.011 0.524 . . . . 0.0 111.806 177.434 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -77.34 -35.31 54.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.133 -178.678 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -68.59 -51.88 28.56 Favored Glycine 0 C--N 1.331 0.259 0 N-CA-C 111.417 -0.673 . . . . 0.0 111.417 179.519 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.7 tt -55.55 -37.4 67.93 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.846 -0.428 . . . . 0.0 109.846 174.233 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.557 ' O ' ' HG3' ' A' ' 30' ' ' ARG . 43.0 tt0 -62.34 -47.82 82.55 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.674 178.709 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -66.57 -40.52 89.01 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.108 0.48 . . . . 0.0 110.327 179.123 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -65.34 -41.53 93.83 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.958 -177.013 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.453 HG23 ' O ' ' A' ' 26' ' ' GLU . 10.4 t -66.36 -36.11 82.05 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 120.559 0.219 . . . . 0.0 110.693 -179.0 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.557 ' HG3' ' O ' ' A' ' 26' ' ' GLU . 49.3 mtt180 -59.27 -43.57 92.48 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 121.17 0.51 . . . . 0.0 110.067 177.166 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.551 ' O ' HG21 ' A' ' 34' ' ' THR . 87.9 t80 -72.81 -46.67 51.91 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.778 -179.819 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 20.8 tp -60.28 -26.37 66.43 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.575 -173.278 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.411 ' NZ ' ' OG1' ' A' ' 29' ' ' THR . 46.5 mttp -66.12 -18.57 65.43 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 112.276 0.473 . . . . 0.0 112.276 -179.522 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.551 HG21 ' O ' ' A' ' 31' ' ' PHE . 5.9 t -77.09 -21.06 54.91 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 120.68 0.276 . . . . 0.0 110.84 -179.171 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -111.66 -7.07 14.28 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.965 -178.654 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 62.02 17.29 8.91 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.87 -0.605 . . . . 0.0 112.036 175.681 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 32.0 t -78.47 6.54 8.31 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.479 0.656 . . . . 0.0 110.128 178.246 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -64.2 -19.16 65.15 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.605 -176.378 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -58.61 -29.08 66.2 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 121.104 0.478 . . . . 0.0 110.178 177.681 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.592 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 90.5 m-20 -73.82 -50.39 20.66 Favored 'General case' 0 C--O 1.242 0.678 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.029 -179.215 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.457 HG13 ' CZ2' ' A' ' 44' ' ' TRP . 13.3 tt -63.96 -42.36 95.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 -179.816 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.531 ' HA ' ' HB ' ' A' ' 45' ' ' ILE . 48.8 mt-10 -65.92 -26.48 67.62 Favored 'General case' 0 N--CA 1.461 0.124 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.77 177.962 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.592 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 37.9 t80 -56.6 -61.35 2.48 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 116.583 -0.28 . . . . 0.0 110.291 175.869 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.457 ' CZ2' HG13 ' A' ' 41' ' ' ILE . 39.9 p-90 -78.68 -18.29 54.61 Favored 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 119.432 -0.907 . . . . 0.0 111.555 -178.072 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.531 ' HB ' ' HA ' ' A' ' 42' ' ' GLU . 24.0 mt -64.13 -37.37 79.7 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.287 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 169.771 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.04 -35.61 81.28 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.7 174.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.819 ' SG ' ' HB2' ' A' ' 101' ' ' PHE . 41.6 t -64.89 -36.09 83.23 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.819 175.131 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.583 ' HA ' ' HB3' ' A' ' 51' ' ' LYS . 15.7 mt-10 -77.95 -25.02 47.98 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 121.009 -0.276 . . . . 0.0 110.56 177.851 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -64.34 -38.56 91.48 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.851 0.834 . . . . 0.0 108.816 171.005 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -64.73 -37.74 88.62 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.405 -1.271 . . . . 0.0 110.102 172.462 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.583 ' HB3' ' HA ' ' A' ' 48' ' ' GLU . 4.7 tmtm? -70.59 -23.1 62.51 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.473 178.65 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.468 ' HG3' ' O ' ' A' ' 48' ' ' GLU . 57.6 mtpt -57.83 -37.11 73.25 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.164 0.507 . . . . 0.0 110.779 177.25 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 10.2 p -91.11 154.26 19.49 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.076 -177.055 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.01 9.66 4.9 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.977 -179.13 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . 0.425 ' O ' HG12 ' A' ' 59' ' ' ILE . . . -83.28 121.23 5.41 Favored Glycine 0 C--N 1.332 0.356 0 N-CA-C 111.465 -0.654 . . . . 0.0 111.465 176.167 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_endo -55.34 -31.7 78.19 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 122.871 2.381 . . . . 0.0 112.768 -174.284 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . 0.503 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 24.6 mp0 -67.12 -51.33 55.36 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 176.897 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 7.9 tp60 -55.27 -38.92 69.2 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.414 179.008 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.425 HG12 ' O ' ' A' ' 55' ' ' GLY . 39.9 mm -52.3 -57.82 3.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.056 179.757 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 70.5 m-70 -64.37 -37.52 87.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.556 -0.293 . . . . 0.0 111.094 -176.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 57' ' ' GLN . 89.0 mt -58.26 -60.9 3.04 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-O 120.865 0.364 . . . . 0.0 110.962 -179.141 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -65.37 -45.24 84.88 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.234 -177.395 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.8 -49.26 77.21 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.82 0.343 . . . . 0.0 111.333 -178.104 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -66.26 -30.77 71.28 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.488 -177.391 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -69.73 -53.98 15.88 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.527 178.375 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 74.3 mt -58.21 -35.49 53.42 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 CA-C-O 121.324 0.583 . . . . 0.0 110.078 177.799 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 85.5 t80 -56.04 -58.27 8.6 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.622 177.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -71.63 -25.42 62.15 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.092 -0.504 . . . . 0.0 112.218 -175.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 65.7 tttp -86.78 -29.02 22.63 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 111.566 0.21 . . . . 0.0 111.566 -176.705 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -127.76 -53.94 1.33 Allowed 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -174.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 45.2 mm -71.51 -19.77 20.69 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 CA-C-O 120.77 0.319 . . . . 0.0 111.575 -171.238 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.46 ' HB3' ' HB1' ' A' ' 75' ' ' ALA . 53.9 tp60 -51.74 135.89 28.5 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.811 178.544 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 19.3 p -50.8 -49.79 57.65 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.942 -176.119 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -85.89 -62.89 1.42 Allowed 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 174.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.46 ' HB1' ' HB3' ' A' ' 72' ' ' GLN . . . 60.09 158.57 0.11 Allowed Pre-proline 0 N--CA 1.469 0.485 0 C-N-CA 122.996 0.518 . . . . 0.0 112.253 176.316 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -70.18 -23.76 28.53 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.218 1.945 . . . . 0.0 111.26 173.097 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -95.81 -41.11 9.0 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.079 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 55.81 88.52 0.04 OUTLIER 'General case' 0 C--O 1.234 0.266 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 -172.142 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 24.3 t -90.91 126.34 43.64 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.683 -172.499 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 37.1 m-80 -74.73 15.89 0.33 Allowed 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.591 -177.442 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.429 ' O ' ' HE2' ' A' ' 86' ' ' LYS . 16.8 tp -57.17 146.97 26.23 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.212 -0.449 . . . . 0.0 109.883 174.734 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -46.89 131.07 12.12 Favored 'General case' 0 C--O 1.237 0.414 0 O-C-N 123.606 0.566 . . . . 0.0 112.39 -176.524 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 36.6 p90 -55.94 -44.98 78.89 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.155 -0.93 . . . . 0.0 111.744 -177.39 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . 0.443 ' O ' HG22 ' A' ' 88' ' ' VAL . 81.1 t60 -67.92 -32.83 73.56 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.83 0.348 . . . . 0.0 110.32 -176.661 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 49.7 m -65.86 -47.19 75.75 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.025 176.696 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.429 ' HE2' ' O ' ' A' ' 81' ' ' LEU . 58.0 mtmt -65.06 -30.72 71.7 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.151 176.959 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -63.52 -50.0 71.31 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.827 179.035 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.443 HG22 ' O ' ' A' ' 84' ' ' HIS . 91.8 t -56.77 -44.91 82.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 121.003 0.43 . . . . 0.0 110.173 178.489 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 70.5 mt -63.22 -47.43 92.3 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.073 -178.768 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 20.2 p -61.64 -26.07 67.77 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 120.763 0.316 . . . . 0.0 111.681 -176.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 42.0 m-80 -94.85 -14.69 24.35 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 111.663 0.245 . . . . 0.0 111.663 178.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 33.0 m -108.45 -4.77 17.03 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 111.664 0.246 . . . . 0.0 111.664 -177.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.444 ' O ' ' HD3' ' A' ' 96' ' ' PRO . 9.6 tp -61.35 -18.72 18.99 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 CA-C-O 120.878 0.371 . . . . 0.0 111.363 -177.757 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.508 HG21 ' HG2' ' A' ' 95' ' ' GLN . 8.9 t -60.72 -29.55 69.43 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.595 177.667 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.508 ' HG2' HG21 ' A' ' 94' ' ' THR . 3.4 pt20 -149.2 77.44 9.05 Favored Pre-proline 0 CA--C 1.532 0.288 0 CA-C-O 121.351 0.596 . . . . 0.0 110.172 178.123 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . 0.444 ' HD3' ' O ' ' A' ' 93' ' ' ILE . 72.3 Cg_endo -73.78 129.76 13.86 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.602 2.201 . . . . 0.0 112.125 -178.033 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 68.7 p -85.04 175.3 9.11 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.29 177.615 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 31.1 tp -60.56 -19.12 56.5 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 121.434 0.635 . . . . 0.0 110.675 -179.118 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . 0.779 ' HB3' ' HB2' ' A' ' 102' ' ' ASP . 28.5 m-70 -128.49 39.16 3.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.987 178.226 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 22.4 t -59.41 -30.99 68.86 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.121 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.819 ' HB2' ' SG ' ' A' ' 47' ' ' CYS . 59.0 m-85 -104.38 19.74 19.72 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.578 -178.704 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . 0.779 ' HB2' ' HB3' ' A' ' 99' ' ' HIS . 24.2 t70 -58.88 -43.07 90.84 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.265 -175.786 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.453 ' O ' ' HG2' ' A' ' 107' ' ' ARG . . . -68.66 -41.29 79.51 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.105 179.232 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -58.42 -39.9 81.05 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.166 178.035 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.456 ' HG2' ' HB2' ' A' ' 44' ' ' TRP . 23.0 tm0? -57.54 -51.27 70.15 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.769 177.833 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 36.3 t -63.61 -37.08 85.98 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.159 -178.102 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . 0.517 ' O ' ' HG ' ' A' ' 111' ' ' LEU . 12.3 mmm180 -67.25 -46.88 72.41 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.504 0.192 . . . . 0.0 111.095 -178.553 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 61.4 t -68.85 -34.99 67.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 121.348 0.594 . . . . 0.0 109.927 177.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . 0.443 ' HH ' ' HB2' ' A' ' 16' ' ' ASP . 2.6 t80 -55.49 -51.75 65.94 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.548 175.087 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.479 ' O ' ' HG2' ' A' ' 114' ' ' GLN . 3.9 pt20 -69.68 -29.67 67.16 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.068 -177.819 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 107' ' ' ARG . 80.9 mt -63.02 -43.55 98.42 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 120.907 0.384 . . . . 0.0 110.465 177.295 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 43.5 mtm -74.27 -28.52 61.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.024 0.44 . . . . 0.0 110.06 177.605 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . 0.581 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 8.2 tm-20 -60.28 -65.48 0.68 Allowed 'General case' 0 C--O 1.236 0.373 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.333 179.211 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . 0.479 ' HG2' ' O ' ' A' ' 110' ' ' GLN . 14.6 pt20 -56.22 -28.7 59.33 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 -174.468 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -105.91 -62.38 1.38 Allowed 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -176.473 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 12.9 m -75.93 -37.95 58.17 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 111.933 0.345 . . . . 0.0 111.933 -173.346 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . 0.581 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 25.6 t80 -72.83 -40.43 65.77 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.775 -0.193 . . . . 0.0 111.136 -174.328 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 24.6 p -57.57 -53.22 60.68 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-O 121.368 0.604 . . . . 0.0 109.851 175.653 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . 0.423 HH11 ' HD3' ' A' ' 119' ' ' ARG . 28.9 mtp-105 -58.75 -38.47 78.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.007 177.119 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -61.6 -39.18 90.31 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.735 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.476 HD11 ' CZ ' ' A' ' 117' ' ' TYR . 82.4 mt -70.09 -27.24 64.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.816 0.341 . . . . 0.0 110.88 179.167 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . 0.743 ' HE3' ' HA ' ' A' ' 122' ' ' LYS . 0.2 OUTLIER -100.41 1.49 41.37 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.112 -178.979 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 83.5 p -64.68 148.14 51.62 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 120.778 0.323 . . . . 0.0 110.838 -177.587 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -63.06 -35.28 79.71 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.523 -178.602 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 6.4 tp -64.12 -40.37 88.8 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.864 178.002 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 83.2 t80 -60.34 -43.09 96.77 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.145 0.498 . . . . 0.0 109.893 178.28 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 69.4 mt -66.12 -31.52 72.42 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.436 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -64.84 -38.77 92.09 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.997 176.676 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 86.6 mt -61.7 -40.71 95.98 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.927 175.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' MET . . . . . . . . . . . . . 86.9 mmm -64.72 -33.88 77.0 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.412 179.45 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 -59.28 -27.06 65.49 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.353 176.152 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . -60.75 -36.27 91.47 Favored Glycine 0 N--CA 1.45 -0.409 0 CA-C-N 115.951 -0.568 . . . . 0.0 112.096 177.841 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 33.1 mtm180 64.7 147.35 0.1 OUTLIER Pre-proline 0 CA--C 1.536 0.431 0 C-N-CA 122.887 0.475 . . . . 0.0 111.22 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_exo . . . . . 0 C--N 1.347 0.492 0 C-N-CA 122.536 2.158 . . . . 0.0 112.286 -179.738 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 20.2 m . . . . . 0 N--CA 1.477 0.914 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 27.6 ttt -89.49 101.98 14.66 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 109.149 -0.685 . . . . 0.0 109.149 173.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.5 p -83.84 139.33 17.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.239 -177.534 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.0 m -86.72 148.25 45.62 Favored Pre-proline 0 CA--C 1.534 0.33 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 175.286 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -53.63 -30.63 56.27 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.743 2.295 . . . . 0.0 113.04 -173.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 28.5 tp10 -60.52 -43.15 97.45 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 121.173 0.511 . . . . 0.0 110.303 177.155 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -76.55 -32.5 58.24 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.944 179.478 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.14 -49.91 70.28 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.848 179.19 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 33.7 m -66.9 -28.34 42.69 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 177.539 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.548 ' O ' ' HD2' ' A' ' 17' ' ' LYS . 8.4 tppt? -57.85 -48.85 78.59 Favored 'General case' 0 CA--C 1.527 0.094 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.388 176.523 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . 0.429 ' HB3' HD11 ' A' ' 18' ' ' LEU . 49.1 m0 -59.54 -33.11 70.97 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.505 178.224 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -69.11 -8.18 58.07 Favored Glycine 0 C--N 1.331 0.281 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.903 -178.607 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -79.37 -34.14 42.29 Favored 'General case' 0 C--N 1.33 -0.248 0 O-C-N 122.839 -0.212 . . . . 0.0 110.618 177.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.477 ' HB3' ' HG2' ' A' ' 17' ' ' LYS . 35.5 t -161.0 129.26 4.43 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 120.996 0.427 . . . . 0.0 111.56 -176.01 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.437 ' O ' HD12 ' A' ' 19' ' ' LEU . 10.1 t80 -58.23 -27.61 64.1 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.597 175.775 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -60.78 -48.71 80.56 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.048 177.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.548 ' HD2' ' O ' ' A' ' 10' ' ' LYS . 19.3 ptpt -80.19 -11.74 59.71 Favored 'General case' 0 C--O 1.233 0.192 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.796 -177.007 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.429 HD11 ' HB3' ' A' ' 11' ' ' TRP . 60.0 tp -69.0 -45.93 69.32 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 170.411 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.437 HD12 ' O ' ' A' ' 15' ' ' PHE . 8.0 mp -61.83 -30.31 70.75 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.839 176.268 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.4 t -58.12 -21.13 45.19 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.168 178.439 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -102.41 136.5 42.12 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 176.634 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.03 -47.56 50.89 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 121.137 0.494 . . . . 0.0 110.098 177.329 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 30.2 p-10 -69.78 -33.9 73.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.277 178.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -64.14 -45.5 93.57 Favored Glycine 0 C--N 1.333 0.377 0 N-CA-C 111.388 -0.685 . . . . 0.0 111.388 173.363 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.5 tp -53.38 -52.4 59.41 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.365 0.603 . . . . 0.0 110.158 174.067 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.637 ' O ' ' HG2' ' A' ' 30' ' ' ARG . 27.9 tt0 -60.33 -42.4 95.56 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.514 -177.663 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -55.21 -47.3 75.51 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-O 121.28 0.562 . . . . 0.0 110.134 177.669 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 90.6 t80 -59.92 -49.09 79.04 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.633 178.236 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.552 HG22 ' HA ' ' A' ' 26' ' ' GLU . 6.0 t -65.88 -24.57 66.88 Favored 'General case' 0 C--O 1.225 -0.211 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.571 -177.243 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.637 ' HG2' ' O ' ' A' ' 26' ' ' GLU . 31.5 mmt180 -57.56 -48.96 77.91 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 173.391 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.585 ' O ' HG22 ' A' ' 34' ' ' THR . 86.5 t80 -69.73 -33.83 73.02 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.655 178.434 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.449 HD21 ' HB ' ' A' ' 41' ' ' ILE . 27.5 tp -72.71 -26.19 61.5 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 121.005 0.431 . . . . 0.0 110.916 -178.241 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.497 ' HG3' ' O ' ' A' ' 29' ' ' THR . 28.2 mtpp -75.4 -38.29 59.97 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.091 179.652 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.585 HG22 ' O ' ' A' ' 31' ' ' PHE . 12.0 t -68.18 -15.96 63.79 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 120.804 0.335 . . . . 0.0 110.825 -176.689 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -109.55 23.78 13.97 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.265 175.437 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 50.4 p90 45.12 26.24 0.22 Allowed 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.603 1.161 . . . . 0.0 113.587 174.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 10.4 t -108.04 20.13 19.11 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.043 0.449 . . . . 0.0 110.193 -179.219 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.618 ' O ' HG23 ' A' ' 41' ' ' ILE . 10.2 pt-20 -63.34 -22.44 66.88 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.564 -176.603 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -53.02 -26.37 15.3 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.662 0.268 . . . . 0.0 111.263 -179.584 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.418 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 8.4 m120 -67.12 -49.7 63.99 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-O 121.047 0.451 . . . . 0.0 110.447 177.761 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.618 HG23 ' O ' ' A' ' 38' ' ' GLU . 6.3 tp -63.85 -42.75 96.87 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.122 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.197 -176.555 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -71.63 -25.84 62.32 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.26 -178.193 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.436 ' HE1' ' HB3' ' A' ' 70' ' ' PHE . 41.3 t80 -60.57 -67.86 0.36 Allowed 'General case' 0 C--O 1.237 0.412 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.969 179.483 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.515 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 35.6 p-90 -75.96 -23.57 55.36 Favored 'General case' 0 C--O 1.225 -0.187 0 C-N-CA 119.402 -0.919 . . . . 0.0 111.954 -174.821 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 26.4 mt -57.9 -38.67 67.58 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 C-N-CA 120.405 -0.518 . . . . 0.0 109.769 172.237 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.03 -37.24 85.39 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 121.137 0.494 . . . . 0.0 110.034 175.19 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.564 ' O ' ' HB3' ' A' ' 50' ' ' PHE . 71.6 m -72.15 -17.17 61.98 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.297 177.685 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.515 ' HG2' ' O ' ' A' ' 44' ' ' TRP . 12.3 mm-40 -73.98 -37.36 64.48 Favored 'General case' 0 C--O 1.225 -0.22 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 171.286 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.448 ' O ' ' HB2' ' A' ' 52' ' ' LYS . 5.8 m-20 -59.12 -29.77 67.64 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 172.149 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.564 ' HB3' ' O ' ' A' ' 47' ' ' CYS . 85.2 t80 -64.43 -40.61 96.08 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.971 173.875 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.553 ' HE3' ' CE1' ' A' ' 99' ' ' HIS . 60.0 mttp -58.87 -31.78 68.87 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.091 0.472 . . . . 0.0 110.236 173.552 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.554 ' N ' ' HE2' ' A' ' 52' ' ' LYS . 1.1 mpmm? -70.1 -24.73 63.25 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.419 -179.851 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.462 ' HB3' ' HG3' ' A' ' 58' ' ' GLN . 39.1 m -60.73 127.42 31.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.714 0.768 . . . . 0.0 110.963 -177.289 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 28.5 tptp -110.58 128.7 55.77 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 114.647 -1.161 . . . . 0.0 110.152 -176.072 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 100.68 131.64 7.46 Favored Glycine 0 CA--C 1.519 0.282 0 N-CA-C 111.701 -0.56 . . . . 0.0 111.701 -178.292 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.466 ' O ' ' HD2' ' A' ' 60' ' ' HIS . 12.1 Cg_endo -54.54 -46.52 32.84 Favored 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 122.794 2.329 . . . . 0.0 111.847 -178.492 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -53.7 -48.0 69.96 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.058 0.456 . . . . 0.0 110.282 178.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.462 ' HG3' ' HB3' ' A' ' 53' ' ' SER . 8.4 tp-100 -55.57 -42.77 75.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.121 177.033 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.524 HG22 ' HG2' ' A' ' 96' ' ' PRO . 47.5 mm -60.85 -39.9 83.44 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.024 179.334 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.466 ' HD2' ' O ' ' A' ' 56' ' ' PRO . 74.2 m-70 -61.93 -55.02 33.84 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 120.673 0.273 . . . . 0.0 110.854 -179.207 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.529 HD13 ' N ' ' A' ' 62' ' ' LYS . 4.2 pp -67.69 -35.66 79.23 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.357 -176.217 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.529 ' N ' HD13 ' A' ' 61' ' ' LEU . 32.0 mmtp -65.67 -38.8 90.31 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 120.946 0.403 . . . . 0.0 110.005 176.363 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.83 -49.03 79.13 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.751 179.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 53.7 mmtt -54.26 -43.07 70.64 Favored 'General case' 0 N--CA 1.466 0.351 0 O-C-N 123.273 0.358 . . . . 0.0 111.191 178.256 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.02 -61.07 2.55 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.064 -179.895 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 63.9 mt -64.08 -37.6 80.27 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-O 121.334 0.588 . . . . 0.0 110.586 -178.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -57.24 -57.39 12.84 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.179 -177.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -78.15 -23.04 47.9 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.919 -172.796 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -99.76 -16.82 17.98 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -174.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . 0.436 ' HB3' ' HE1' ' A' ' 43' ' ' PHE . 97.3 m-85 -132.56 -49.17 0.9 Allowed 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 -176.405 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 50.6 mm -74.89 -32.51 27.88 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -169.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 51.2 mm-40 -64.67 143.44 57.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.98 0.419 . . . . 0.0 111.556 179.818 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 22.1 m -62.46 -28.94 70.17 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.212 177.223 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -98.47 24.43 7.38 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.501 -178.211 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.413 ' C ' ' H ' ' A' ' 77' ' ' LYS . . . -89.57 152.31 47.03 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.58 179.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_exo -67.34 15.81 0.13 Allowed 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 123.248 2.632 . . . . 0.0 113.732 -177.165 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.413 ' H ' ' C ' ' A' ' 75' ' ' ALA . 0.0 OUTLIER -130.4 -27.21 2.21 Favored 'General case' 0 C--N 1.331 -0.238 0 O-C-N 122.333 -0.229 . . . . 0.0 111.236 177.852 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 48.73 42.21 19.27 Favored 'General case' 0 N--CA 1.466 0.353 0 O-C-N 123.498 0.499 . . . . 0.0 110.937 177.055 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 58.3 t -47.47 133.34 4.42 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 CA-C-N 115.264 -0.88 . . . . 0.0 111.848 -174.653 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.463 ' N ' HD21 ' A' ' 80' ' ' ASN . 0.9 OUTLIER -70.84 76.46 0.62 Allowed 'General case' 0 C--O 1.237 0.413 0 CA-C-O 121.283 0.563 . . . . 0.0 110.911 -178.558 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.542 HD23 ' HB3' ' A' ' 86' ' ' LYS . 55.2 tp -113.79 144.68 42.59 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.32 -0.854 . . . . 0.0 109.918 177.075 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -67.2 145.73 54.92 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 120.815 0.341 . . . . 0.0 110.91 178.644 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 91.7 t80 -58.32 -50.85 72.16 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.465 -176.602 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . 0.427 ' O ' ' HB3' ' A' ' 87' ' ' GLU . 85.7 t60 -61.14 -33.26 73.12 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.615 0.245 . . . . 0.0 111.176 -175.61 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 25.7 m -69.03 -50.13 51.43 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.805 0.336 . . . . 0.0 110.79 178.671 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.542 ' HB3' HD23 ' A' ' 81' ' ' LEU . 12.2 ptmm? -70.69 -19.96 62.73 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.084 0.468 . . . . 0.0 110.295 178.645 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.427 ' HB3' ' O ' ' A' ' 84' ' ' HIS . 37.1 tt0 -61.84 -54.77 37.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.613 173.6 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.415 HG22 ' O ' ' A' ' 84' ' ' HIS . 59.2 t -55.01 -41.24 57.65 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.215 178.077 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 73.2 mt -60.15 -53.21 51.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.118 179.722 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.502 HG22 ' O ' ' A' ' 86' ' ' LYS . 66.7 p -58.48 -30.57 67.1 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 120.799 0.333 . . . . 0.0 111.596 -176.173 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 41.8 m-80 -83.53 -29.56 27.79 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.492 -179.521 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 16.1 m -101.14 -0.99 35.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.711 0.291 . . . . 0.0 111.4 -175.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.5 tp -61.97 -21.2 25.61 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-O 120.851 0.358 . . . . 0.0 111.357 -176.65 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 9.5 t -62.64 -37.83 87.89 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.623 179.255 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -138.83 77.15 33.14 Favored Pre-proline 0 C--O 1.234 0.272 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.259 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . 0.524 ' HG2' HG22 ' A' ' 59' ' ' ILE . 72.8 Cg_endo -76.92 151.76 31.43 Favored 'Trans proline' 0 C--O 1.235 0.374 0 C-N-CA 122.649 2.232 . . . . 0.0 112.102 -178.173 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 5.8 m -96.43 168.71 10.39 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 116.035 -0.529 . . . . 0.0 109.823 178.353 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 61.1 tp -45.79 -36.61 5.29 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 -175.275 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . 0.767 ' HB3' ' HB2' ' A' ' 102' ' ' ASP . 55.1 m-70 -98.13 -52.5 3.67 Favored 'General case' 0 N--CA 1.464 0.242 0 O-C-N 122.25 -0.281 . . . . 0.0 110.852 -179.255 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 33.2 t 51.5 -81.94 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.105 0.562 . . . . 0.0 112.507 174.923 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . 0.444 ' N ' ' O ' ' A' ' 99' ' ' HIS . 50.4 m-85 -74.55 -1.55 21.91 Favored 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 122.635 0.374 . . . . 0.0 111.287 -174.981 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . 0.767 ' HB2' ' HB3' ' A' ' 99' ' ' HIS . 8.0 t70 -51.52 -43.53 62.3 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.44 -176.205 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.33 -41.29 88.8 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 121.256 0.551 . . . . 0.0 110.373 177.269 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.09 -36.35 83.73 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.348 178.181 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.449 ' OE1' ' SG ' ' A' ' 47' ' ' CYS . 15.9 mm-40 -66.38 -36.84 83.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.449 179.583 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 52.0 m -62.06 -35.4 78.51 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.573 177.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . 0.503 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 0.0 OUTLIER -60.69 -49.47 77.4 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-O 121.025 0.441 . . . . 0.0 110.06 178.228 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.48 HG13 ' SD ' ' A' ' 112' ' ' MET . 96.7 t -64.28 -46.0 94.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.285 178.022 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -52.5 -47.06 66.82 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.601 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . 0.503 ' HG3' ' O ' ' A' ' 107' ' ' ARG . 0.0 OUTLIER -70.64 -31.06 67.85 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 121.139 -0.224 . . . . 0.0 110.773 -176.077 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.494 ' HA ' HE21 ' A' ' 114' ' ' GLN . 95.2 mt -62.58 -49.0 77.0 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.482 0.658 . . . . 0.0 109.339 172.831 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' MET . . . . . 0.48 ' SD ' HG13 ' A' ' 108' ' ' VAL . 66.0 mtp -60.42 -38.17 83.21 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.296 178.811 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . 0.605 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 39.7 tt0 -61.23 -65.72 0.65 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.718 -178.825 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . 0.494 HE21 ' HA ' ' A' ' 111' ' ' LEU . 27.2 pt20 -60.93 -32.34 71.84 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.861 -174.426 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -90.4 -70.29 0.68 Allowed 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 -177.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 4.7 p -86.28 -25.01 25.72 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 -169.115 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . 0.605 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 38.2 t80 -71.55 -41.08 69.55 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 118.398 0.545 . . . . 0.0 110.659 -178.407 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 31.6 p -60.35 -51.99 67.17 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 121.321 0.581 . . . . 0.0 110.141 176.799 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 43.2 mtm-85 -59.03 -36.04 74.31 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.445 177.434 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 65.7 t80 -62.78 -38.09 89.25 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.616 177.442 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 82.5 mt -65.35 -27.22 68.43 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.788 0.327 . . . . 0.0 110.641 178.583 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . 0.78 ' HE2' ' HA ' ' A' ' 122' ' ' LYS . 10.4 mmpt? -102.6 1.83 35.28 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.784 178.729 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' SER . . . . . 0.451 ' OG ' HG22 ' A' ' 125' ' ' ILE . 79.0 p -72.96 143.16 47.74 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.749 0.309 . . . . 0.0 110.707 -179.352 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -59.99 -25.98 65.69 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.213 178.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.461 HD11 ' O ' ' A' ' 125' ' ' ILE . 0.0 OUTLIER -67.27 -36.64 77.27 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 177.854 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 84.0 t80 -64.61 -38.45 91.06 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 121.068 0.461 . . . . 0.0 109.913 174.696 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.498 HD12 ' HG3' ' A' ' 130' ' ' MET . 4.4 mm? -65.17 -22.59 66.93 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.751 177.027 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -73.9 -33.44 64.0 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 121.193 0.521 . . . . 0.0 109.683 173.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 66.9 mt -72.76 -23.38 60.81 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.796 178.09 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' MET . . . . . 0.544 ' HA ' ' HE3' ' A' ' 130' ' ' MET . 2.4 mmt -60.72 -69.54 0.22 Allowed 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.954 179.997 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 52.39 34.47 15.17 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 121.867 0.841 . . . . 0.0 109.844 -177.712 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . -84.15 61.06 4.77 Favored Glycine 0 N--CA 1.45 -0.39 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.96 -178.513 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 24.1 ttm180 -76.69 117.14 62.63 Favored Pre-proline 0 C--N 1.327 -0.389 0 C-N-CA 122.259 0.224 . . . . 0.0 110.438 179.221 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo . . . . . 0 C--N 1.347 0.48 0 C-N-CA 122.644 2.229 . . . . 0.0 112.757 -179.742 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 48.2 t . . . . . 0 N--CA 1.481 1.097 0 CA-C-O 120.68 0.276 . . . . 0.0 110.313 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 26.9 ptt? -64.43 127.01 29.66 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.032 177.65 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.2 p -93.44 143.61 11.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 120.776 0.322 . . . . 0.0 110.885 -178.403 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 49.8 m -80.02 141.87 55.11 Favored Pre-proline 0 C--O 1.236 0.349 0 CA-C-N 116.148 -0.478 . . . . 0.0 109.996 176.136 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -51.39 -35.01 52.91 Favored 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 122.804 2.336 . . . . 0.0 112.898 -177.14 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.511 ' O ' ' HG2' ' A' ' 10' ' ' LYS . 14.5 mm-40 -69.0 -34.68 75.67 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.991 -179.359 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 23.4 mm-40 -71.44 -32.79 68.75 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 172.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.35 -42.81 98.95 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.706 178.944 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.465 HG23 ' O ' ' A' ' 6' ' ' GLU . 17.4 m -69.71 -28.31 36.79 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-O 120.98 0.419 . . . . 0.0 110.087 176.914 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.524 ' HA ' ' HG2' ' A' ' 13' ' ' GLU . 71.6 mmtt -66.56 -31.06 71.53 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.368 174.981 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . 0.436 ' CD1' ' HG2' ' A' ' 17' ' ' LYS . 48.2 m0 -62.24 -25.75 68.0 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 173.183 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -79.85 -22.99 62.76 Favored Glycine 0 C--N 1.333 0.405 0 CA-C-N 115.565 -0.743 . . . . 0.0 112.927 -178.551 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.524 ' HG2' ' HA ' ' A' ' 10' ' ' LYS . 8.2 pt-20 -101.88 -18.07 15.89 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.821 0.31 . . . . 0.0 110.871 178.278 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 42.1 m -134.8 96.97 3.65 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.893 0.377 . . . . 0.0 111.519 -177.779 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -58.28 -34.13 70.18 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 175.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -54.55 -48.94 71.41 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.802 174.367 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.436 ' HG2' ' CD1' ' A' ' 11' ' ' TRP . 22.0 ttmm -67.22 -35.24 79.17 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.8 -177.494 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 67.1 tp -57.63 -49.58 75.96 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.066 -0.516 . . . . 0.0 109.924 176.453 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.5 mp -73.45 -30.26 63.08 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.966 179.748 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 26.0 t -63.73 -41.12 98.11 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.194 179.666 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 21.1 m-70 -77.49 115.88 17.61 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 175.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.401 ' HD2' ' N ' ' A' ' 22' ' ' ARG . 8.3 mpt_? -53.15 -35.26 59.56 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 120.86 0.362 . . . . 0.0 110.667 -177.852 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -66.25 -42.99 87.76 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.378 177.521 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -65.68 -50.51 53.66 Favored Glycine 0 C--N 1.335 0.483 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.877 179.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 11.5 tp -47.83 -51.59 22.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.367 0.603 . . . . 0.0 110.584 174.514 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.507 ' O ' ' HG3' ' A' ' 30' ' ' ARG . 12.8 tp10 -65.03 -40.25 94.56 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.77 -176.7 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.07 -41.76 98.5 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.046 0.451 . . . . 0.0 110.629 178.281 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 83.5 t80 -71.71 -45.57 61.4 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.152 -176.201 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.632 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 9.0 t -60.79 -45.27 95.05 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 120.937 -0.305 . . . . 0.0 110.399 -177.788 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.507 ' HG3' ' O ' ' A' ' 26' ' ' GLU . 73.8 mtt-85 -58.92 -40.48 84.67 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.017 0.437 . . . . 0.0 109.988 178.361 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.516 ' O ' HG21 ' A' ' 34' ' ' THR . 94.5 t80 -63.92 -30.88 71.93 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.479 177.549 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.445 HD23 HG23 ' A' ' 41' ' ' ILE . 18.9 tp -85.72 -20.11 29.82 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.464 -179.028 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.632 ' HG3' ' O ' ' A' ' 29' ' ' THR . 66.1 mttm -77.6 -36.14 52.11 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.018 178.951 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.516 HG21 ' O ' ' A' ' 31' ' ' PHE . 14.8 t -63.81 -29.96 71.1 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 120.884 0.373 . . . . 0.0 110.972 -177.919 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -91.99 2.77 56.34 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.412 177.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 89.9 m-85 55.96 47.22 20.41 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.318 179.176 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 20.3 t -131.17 15.17 5.14 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.466 176.188 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.423 ' HB2' ' OE1' ' A' ' 42' ' ' GLU . 0.1 OUTLIER -57.16 -24.25 53.06 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 115.172 -0.922 . . . . 0.0 111.199 -179.374 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.432 ' O ' ' HB2' ' A' ' 43' ' ' PHE . 11.4 pt-20 -40.13 -36.06 0.46 Allowed 'General case' 0 C--O 1.225 -0.236 0 CA-C-N 115.205 -0.907 . . . . 0.0 112.161 178.442 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.441 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 46.5 m-80 -66.95 -62.17 1.57 Allowed 'General case' 0 C--O 1.245 0.816 0 CA-C-O 121.07 0.462 . . . . 0.0 111.528 -176.833 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.512 HD13 ' HB ' ' A' ' 29' ' ' THR . 13.1 tt -62.43 -44.09 98.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.194 -176.608 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.423 ' OE1' ' HB2' ' A' ' 38' ' ' GLU . 0.9 OUTLIER -63.17 -31.5 72.66 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.071 177.365 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.441 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 76.3 t80 -55.93 -60.77 2.99 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 120.706 0.288 . . . . 0.0 110.828 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.516 ' HB2' ' HG3' ' A' ' 105' ' ' GLN . 28.6 p-90 -78.05 -11.16 59.89 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 119.722 -0.791 . . . . 0.0 111.929 -176.15 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.487 HG13 ' O ' ' A' ' 41' ' ' ILE . 54.2 mt -68.66 -39.68 80.68 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 168.2 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.55 -32.37 73.99 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.898 174.157 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.402 ' O ' ' HB3' ' A' ' 50' ' ' PHE . 43.4 t -66.54 -28.78 68.81 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.583 175.792 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.51 ' O ' ' HG3' ' A' ' 51' ' ' LYS . 4.3 tm-20 -72.81 -40.08 66.13 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 177.134 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -65.04 -33.75 76.79 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.821 174.575 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . 0.402 ' HB3' ' O ' ' A' ' 47' ' ' CYS . 74.0 t80 -60.67 -58.73 7.23 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.901 177.017 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.51 ' HG3' ' O ' ' A' ' 48' ' ' GLU . 0.0 OUTLIER -63.29 -20.75 65.76 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 116.615 -0.266 . . . . 0.0 111.491 -179.139 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -72.05 -26.81 62.33 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.893 0.378 . . . . 0.0 110.685 177.216 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 42.7 m -66.65 106.86 1.93 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.996 -177.124 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.24 -4.84 56.95 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.929 179.788 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -80.43 117.04 4.37 Favored Glycine 0 CA--C 1.52 0.373 0 N-CA-C 111.529 -0.628 . . . . 0.0 111.529 175.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -50.82 -46.53 29.86 Favored 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 122.921 2.414 . . . . 0.0 112.687 -177.191 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 7.3 pm0 -71.57 -33.2 68.89 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.037 0.446 . . . . 0.0 109.946 179.562 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -62.2 -36.62 82.47 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.981 -177.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.414 HG22 ' HG2' ' A' ' 96' ' ' PRO . 71.5 mt -53.89 -43.62 57.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.471 176.789 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 68.7 m-70 -63.66 -43.88 95.43 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.192 178.784 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 53.6 mt -64.59 -49.37 71.4 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.138 -175.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -56.48 -50.87 70.5 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.205 179.151 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.97 -41.64 98.24 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.049 -179.686 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 50.5 tptt -59.53 -45.33 92.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.463 -179.534 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.18 -56.18 21.26 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.636 179.099 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 71.0 mt -57.67 -37.08 57.18 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.481 -179.461 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.43 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 86.1 t80 -58.38 -60.82 3.19 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.54 -179.446 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -82.87 -1.05 50.99 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.911 -171.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 57.5 tptt -105.82 -31.76 8.69 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.748 -0.206 . . . . 0.0 111.008 178.238 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 81.2 m-85 -130.01 -43.5 1.2 Allowed 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 -172.242 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . 0.43 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 48.2 mm -77.93 -32.88 17.92 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 CA-C-O 121.046 0.451 . . . . 0.0 111.711 -173.477 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.545 ' HB3' ' HB1' ' A' ' 75' ' ' ALA . 7.0 tp60 -77.02 144.49 38.62 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.196 -173.824 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 89.4 m -71.64 -34.98 70.24 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.826 -178.37 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -87.73 10.58 17.82 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 120.91 0.386 . . . . 0.0 110.747 177.21 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.545 ' HB1' ' HB3' ' A' ' 72' ' ' GLN . . . -69.91 154.11 94.93 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.528 179.15 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -55.18 -28.69 62.66 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.668 2.245 . . . . 0.0 112.25 178.536 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 17.9 tppt? -107.3 -69.51 0.84 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.488 -178.095 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 63.07 108.17 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.273 0.559 . . . . 0.0 110.023 -170.48 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 48.9 t -93.9 155.61 3.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.357 -176.515 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.459 ' HB2' HD22 ' A' ' 111' ' ' LEU . 45.0 m-80 -78.02 48.45 0.72 Allowed 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.238 0.542 . . . . 0.0 110.8 -179.746 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.412 HD13 HG22 ' A' ' 85' ' ' THR . 23.4 tp -79.45 151.7 30.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.382 179.291 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -53.88 137.53 38.54 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.827 -179.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 28.8 p90 -59.02 -45.75 89.94 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.438 -176.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 83.3 t60 -69.9 -30.83 68.36 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.764 0.316 . . . . 0.0 110.675 -176.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.412 HG22 HD13 ' A' ' 81' ' ' LEU . 39.3 m -64.8 -50.28 67.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.434 179.484 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.415 ' O ' HG21 ' A' ' 90' ' ' THR . 16.0 ptpt -71.66 -24.1 61.79 Favored 'General case' 0 CA--C 1.527 0.077 0 C-N-CA 120.76 -0.376 . . . . 0.0 110.713 -179.568 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -55.52 -53.88 50.83 Favored 'General case' 0 N--CA 1.462 0.161 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 173.512 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 53.1 t -56.77 -45.61 83.03 Favored 'Isoleucine or valine' 0 C--O 1.234 0.254 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.328 178.016 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 71.9 mt -59.4 -47.64 89.92 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.21 -178.527 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' THR . . . . . 0.415 HG21 ' O ' ' A' ' 86' ' ' LYS . 66.6 p -62.83 -27.06 69.06 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 120.867 0.365 . . . . 0.0 111.052 -178.173 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 82.3 m-20 -90.87 -14.2 32.21 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.459 -179.033 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 14.4 m -118.04 -0.01 11.74 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 111.804 0.298 . . . . 0.0 111.804 -176.071 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 7.8 tp -59.9 -23.26 26.19 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 CA-C-O 120.802 0.334 . . . . 0.0 111.337 -177.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' THR . . . . . 0.536 HG23 ' HG2' ' A' ' 95' ' ' GLN . 5.9 t -59.79 -32.71 70.86 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.855 178.749 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.536 ' HG2' HG23 ' A' ' 94' ' ' THR . 11.7 pt20 -165.05 93.02 0.92 Allowed Pre-proline 0 CA--C 1.533 0.32 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.051 177.443 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . 0.414 ' HG2' HG22 ' A' ' 59' ' ' ILE . 94.2 Cg_endo -81.8 158.24 18.61 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.82 2.347 . . . . 0.0 112.594 -178.719 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 25.0 p -84.28 173.83 10.66 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.955 177.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -49.62 -43.77 46.85 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 123.208 0.603 . . . . 0.0 112.485 -172.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 -129.11 28.74 5.25 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.208 -173.588 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 6.3 p -46.09 -36.15 5.56 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 112.967 0.729 . . . . 0.0 112.967 -173.685 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -82.06 18.81 1.26 Allowed 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -177.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -70.64 -37.76 73.78 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 121.13 0.49 . . . . 0.0 109.899 179.028 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.428 ' O ' ' HG2' ' A' ' 107' ' ' ARG . . . -61.72 -46.04 91.38 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.724 175.448 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.28 -40.99 96.16 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.493 178.278 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.516 ' HG3' ' HB2' ' A' ' 44' ' ' TRP . 30.4 tt0 -57.83 -45.82 85.63 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.621 177.663 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 18.5 m -63.27 -43.64 97.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.83 -179.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . 0.428 ' HG2' ' O ' ' A' ' 103' ' ' ALA . 20.5 mmt180 -58.14 -53.51 57.49 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.917 179.207 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.437 ' O ' ' SD ' ' A' ' 112' ' ' MET . 99.5 t -69.11 -35.9 70.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.457 -175.794 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . 0.463 ' HA ' ' HE1' ' A' ' 112' ' ' MET . 67.7 t80 -53.8 -54.55 36.72 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.031 0.444 . . . . 0.0 110.826 179.092 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 26.6 pt20 -73.85 -20.15 60.52 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.829 179.235 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.459 HD22 ' HB2' ' A' ' 80' ' ' ASN . 35.6 tp -61.58 -49.66 75.74 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.257 -176.814 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' MET . . . . . 0.463 ' HE1' ' HE1' ' A' ' 44' ' ' TRP . 0.0 OUTLIER -83.5 -29.63 27.81 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 120.312 -0.555 . . . . 0.0 110.263 177.529 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . 0.631 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 40.1 tt0 -52.36 -53.38 45.49 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 120.936 0.398 . . . . 0.0 110.721 179.188 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . 0.4 ' HG2' ' O ' ' A' ' 111' ' ' LEU . 29.8 pt20 -52.58 -18.95 1.98 Allowed 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 113.623 0.971 . . . . 0.0 113.623 -170.638 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . 0.578 ' O ' ' HG3' ' A' ' 119' ' ' ARG . 35.5 t70 -141.84 -52.86 0.43 Allowed 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 118.087 0.403 . . . . 0.0 111.68 -178.715 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 22.6 m -59.83 -31.76 70.03 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 120.665 0.269 . . . . 0.0 111.252 -178.801 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . 0.631 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 16.1 t80 -71.4 -42.75 67.94 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-O 120.647 0.261 . . . . 0.0 110.451 179.795 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 7.8 p -65.99 -35.54 80.87 Favored 'General case' 0 C--O 1.24 0.585 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.635 178.509 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . 0.578 ' HG3' ' O ' ' A' ' 115' ' ' ASP . 95.4 mtt180 -54.42 -51.13 65.9 Favored 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 172.266 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 79.6 t80 -58.39 -38.67 77.78 Favored 'General case' 0 C--O 1.225 -0.211 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.42 179.257 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.426 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 68.4 mt -62.95 -23.34 67.36 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.595 -179.272 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 2.4 tppp? -118.69 12.27 13.01 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.099 0.476 . . . . 0.0 111.311 177.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 95.2 p -71.17 146.81 48.88 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 176.245 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -56.48 -30.39 62.88 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 176.752 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . 0.413 ' O ' ' HG ' ' A' ' 129' ' ' LEU . 78.5 mt -56.94 -54.51 29.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-N 115.138 -0.937 . . . . 0.0 110.335 175.712 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' TYR . . . . . 0.473 ' O ' ' HG2' ' A' ' 130' ' ' MET . 75.7 t80 -64.1 -38.23 90.3 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.442 -178.888 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 92.4 mt -61.87 -36.1 80.25 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.166 177.535 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -70.6 -32.51 69.9 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.112 176.841 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 125' ' ' ILE . 95.9 mt -72.29 -26.82 62.11 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.503 176.43 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' MET . . . . . 0.633 ' HA ' ' HE3' ' A' ' 130' ' ' MET . 27.2 mmt -67.44 -64.64 0.82 Allowed 'General case' 0 C--O 1.232 0.167 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 176.089 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . 0.478 ' HB2' ' O ' ' A' ' 130' ' ' MET . 1.6 tm-20 170.49 -73.41 0.0 OUTLIER 'General case' 0 C--O 1.233 0.196 0 N-CA-C 108.261 -1.015 . . . . 0.0 108.261 179.3 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 167.57 -54.56 0.23 Allowed Glycine 0 N--CA 1.45 -0.431 0 N-CA-C 110.802 -0.919 . . . . 0.0 110.802 -178.576 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 4.3 ptp85 -146.83 91.64 5.19 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 120.67 0.271 . . . . 0.0 110.965 177.274 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo . . . . . 0 C--N 1.349 0.554 0 C-N-CA 122.382 2.055 . . . . 0.0 110.817 172.962 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 7.2 m . . . . . 0 N--CA 1.477 0.898 0 CA-C-O 120.749 0.309 . . . . 0.0 110.563 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 27.3 ttt -148.74 104.19 3.45 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 179.259 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . 0.477 HG21 ' CH2' ' A' ' 11' ' ' TRP . 2.6 p -125.65 146.09 31.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.973 -178.042 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 34.4 m -114.6 155.75 45.65 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.645 177.117 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 80.5 Cg_exo -49.25 -37.11 39.05 Favored 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 122.91 2.407 . . . . 0.0 112.742 -178.401 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.425 ' O ' HG21 ' A' ' 9' ' ' VAL . 5.3 mp0 -64.62 -36.32 83.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.857 179.333 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.451 ' HB3' HG22 ' A' ' 3' ' ' VAL . 25.8 tp10 -68.37 -36.03 78.6 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 175.765 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.93 -41.38 91.43 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.338 179.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . 0.425 HG21 ' O ' ' A' ' 6' ' ' GLU . 19.4 m -70.55 -23.24 24.19 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 CA-C-O 120.895 0.378 . . . . 0.0 110.29 178.717 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.475 ' O ' ' HD2' ' A' ' 17' ' ' LYS . 67.4 mmtt -67.13 -39.34 86.61 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-O 121.077 0.465 . . . . 0.0 109.847 171.68 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . 0.477 ' CH2' HG21 ' A' ' 3' ' ' VAL . 47.1 m0 -62.74 -27.09 69.04 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 175.075 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -72.42 -31.77 62.96 Favored Glycine 0 CA--C 1.52 0.358 0 CA-C-N 115.392 -0.822 . . . . 0.0 112.911 178.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.443 ' HG2' ' O ' ' A' ' 10' ' ' LYS . 11.5 pt-20 -82.56 -23.11 34.65 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 117.147 0.474 . . . . 0.0 111.162 -178.941 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.511 ' HB2' ' HG2' ' A' ' 17' ' ' LYS . 49.8 m -152.22 107.68 3.3 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -179.619 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' PHE . . . . . 0.465 ' CD1' HD22 ' A' ' 18' ' ' LEU . 40.2 t80 -53.65 -27.42 27.3 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.55 175.49 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -59.2 -54.11 50.61 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.328 177.43 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.511 ' HG2' ' HB2' ' A' ' 14' ' ' SER . 17.7 ptpt -71.56 -20.08 62.07 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 120.937 -0.305 . . . . 0.0 110.599 -175.121 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.477 ' O ' ' HA3' ' A' ' 24' ' ' GLY . 48.9 tp -59.01 -48.95 79.75 Favored 'General case' 0 N--CA 1.463 0.183 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 169.656 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.465 HD21 ' CZ2' ' A' ' 44' ' ' TRP . 0.8 OUTLIER -77.44 -27.52 52.22 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.948 -179.539 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.468 ' HB3' ' HA ' ' A' ' 17' ' ' LYS . 9.7 t -74.61 -25.08 59.01 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.508 -178.125 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -92.15 126.79 37.38 Favored 'General case' 0 C--O 1.232 0.179 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 177.784 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 36.2 ttm180 -51.6 -39.71 58.49 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 120.739 0.304 . . . . 0.0 110.569 179.355 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -61.73 -40.55 95.47 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.051 179.212 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.477 ' HA3' ' O ' ' A' ' 18' ' ' LEU . . . -68.11 -48.94 50.43 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.855 -0.688 . . . . 0.0 111.517 -179.416 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 7.8 tt -58.23 -38.66 77.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.025 0.441 . . . . 0.0 110.07 174.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -61.22 -51.71 67.82 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.379 179.234 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -68.73 -32.95 73.1 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.916 179.468 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -73.73 -37.59 65.05 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.951 -176.284 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.439 ' O ' ' HB2' ' A' ' 33' ' ' LYS . 11.2 t -71.23 -44.39 65.43 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 121.027 -0.269 . . . . 0.0 110.58 -178.816 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 11.8 ptm180 -64.71 -32.73 74.53 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 120.847 0.356 . . . . 0.0 110.39 178.842 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 85.7 t80 -70.29 -55.73 8.48 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.205 177.338 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.432 HD23 ' HA ' ' A' ' 38' ' ' GLU . 25.5 tp -67.02 -16.5 64.4 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.996 -176.877 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.439 ' HB2' ' O ' ' A' ' 29' ' ' THR . 22.3 ttmm -69.6 -18.82 63.65 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.699 178.944 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 13.9 t -56.61 -26.32 55.35 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.038 0.447 . . . . 0.0 111.215 -179.145 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -124.59 8.12 8.28 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.39 179.376 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 53.37 41.22 32.14 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.583 176.761 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 50.5 m -107.49 20.51 18.8 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.937 179.551 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.432 ' HA ' HD23 ' A' ' 32' ' ' LEU . 6.6 pt-20 -69.3 -6.94 32.73 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.035 178.684 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -42.73 -38.4 2.07 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.049 171.113 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.514 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 50.0 m-80 -64.75 -57.83 7.89 Favored 'General case' 0 C--O 1.245 0.831 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.568 -176.117 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.44 ' O ' HG13 ' A' ' 45' ' ' ILE . 9.8 tt -60.9 -41.05 87.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.13 -0.486 . . . . 0.0 109.822 -177.85 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.522 ' HA ' ' HB ' ' A' ' 45' ' ' ILE . 53.7 mt-10 -67.14 -30.14 70.05 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.859 178.213 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.514 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 81.4 t80 -54.49 -60.71 2.99 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.559 179.16 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' TRP . . . . . 0.621 ' HA ' ' SG ' ' A' ' 47' ' ' CYS . 26.4 p-90 -79.8 -14.51 58.64 Favored 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 119.357 -0.937 . . . . 0.0 111.614 -178.645 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.522 ' HB ' ' HA ' ' A' ' 42' ' ' GLU . 18.4 mt -62.99 -38.72 82.75 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 168.612 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.93 -36.27 82.91 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.872 174.226 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.621 ' SG ' ' HA ' ' A' ' 44' ' ' TRP . 64.3 m -61.51 -31.08 71.06 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.726 176.566 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.491 ' HG2' ' O ' ' A' ' 44' ' ' TRP . 9.2 mm-40 -73.82 -38.21 64.62 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 120.968 0.413 . . . . 0.0 109.899 176.398 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -57.74 -35.95 71.4 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.409 0.623 . . . . 0.0 109.9 174.446 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 51.0 t80 -72.46 -45.28 60.23 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 114.862 -1.063 . . . . 0.0 110.398 174.371 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.459 ' HB3' ' HA ' ' A' ' 48' ' ' GLU . 4.1 tmtm? -54.73 -38.27 66.92 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.635 -0.711 . . . . 0.0 112.502 -176.631 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 22.9 pttm -72.74 -21.19 61.06 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.043 0.449 . . . . 0.0 110.792 -176.318 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 22.7 m -81.46 75.79 8.41 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.187 -177.427 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.88 -5.99 42.03 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.943 -176.07 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -73.65 125.96 9.55 Favored Glycine 0 CA--C 1.521 0.414 0 C-N-CA 121.142 -0.552 . . . . 0.0 112.258 177.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.442 ' O ' ' HD2' ' A' ' 60' ' ' HIS . 89.0 Cg_exo -48.0 -46.53 21.75 Favored 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 123.037 2.491 . . . . 0.0 112.84 -177.201 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -63.12 -42.3 99.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.625 -179.325 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -64.08 -36.7 84.88 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.578 -177.515 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 30.6 mm -51.96 -55.92 7.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.298 179.111 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.442 ' HD2' ' O ' ' A' ' 56' ' ' PRO . 61.2 m-70 -62.89 -38.76 92.18 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.947 -175.701 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 88.6 mt -69.16 -55.16 11.49 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.012 -178.069 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.454 ' HA ' ' HE2' ' A' ' 62' ' ' LYS . 7.4 mmpt? -59.83 -40.09 87.31 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.013 -178.201 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.12 -46.86 84.85 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.771 178.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 4.2 tppp? -66.04 -32.2 73.54 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.79 -179.63 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.03 -59.16 5.49 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 120.945 0.403 . . . . 0.0 110.25 177.565 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 65.5 mt -59.52 -35.19 57.62 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.331 178.315 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 77.2 t80 -54.17 -63.22 1.22 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.944 -179.713 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -79.35 -9.6 59.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 0.0 112.185 -172.787 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 56.1 tptt -98.02 -33.34 11.22 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 111.627 0.232 . . . . 0.0 111.627 -179.743 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 69.9 m-85 -128.05 -43.86 1.48 Allowed 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -173.34 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 49.6 mm -67.82 -40.49 83.75 Favored 'Isoleucine or valine' 0 C--O 1.238 0.468 0 CA-C-O 120.912 0.387 . . . . 0.0 111.185 -173.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . 0.537 ' HB2' ' HB3' ' A' ' 75' ' ' ALA . 15.8 mm100 -60.59 141.53 56.55 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.541 178.119 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 92.4 m -67.13 -53.25 32.36 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.543 -179.477 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -88.95 27.9 1.27 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.631 -179.506 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.537 ' HB3' ' HB2' ' A' ' 72' ' ' GLN . . . -62.28 160.04 35.27 Favored Pre-proline 0 CA--C 1.531 0.247 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.0 178.358 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -72.19 48.05 1.14 Allowed 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 123.136 2.557 . . . . 0.0 112.48 176.249 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -178.92 -59.0 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 178.07 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 69.86 126.48 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.756 -177.439 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 57.8 t -121.04 138.2 52.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.422 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.935 177.189 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 37.1 m-80 -75.08 86.05 2.35 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.509 0.671 . . . . 0.0 111.075 179.567 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 15.1 tp -125.58 151.92 45.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.102 -0.953 . . . . 0.0 109.974 178.395 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -57.49 135.37 56.61 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.397 179.293 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 81.6 m-85 -67.68 -42.65 81.75 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.06 -175.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 72.7 t60 -58.62 -31.89 68.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.965 0.412 . . . . 0.0 110.381 178.285 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 37.7 m -66.97 -46.54 74.32 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.741 178.346 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -69.68 -24.99 63.67 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.226 -179.419 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -59.24 -52.41 65.79 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.392 0.615 . . . . 0.0 109.892 174.504 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 91.6 t -59.52 -39.28 78.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.027 177.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 81.5 mt -63.41 -43.8 98.65 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.04 179.107 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 33.7 p -65.09 -23.68 67.23 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-O 120.828 0.347 . . . . 0.0 111.097 -178.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 39.2 m-80 -86.92 -21.76 26.09 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.897 176.065 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 28.2 t -99.35 -9.49 23.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.29 -177.345 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.4 tp -58.16 -26.29 29.03 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 CA-C-O 120.783 0.325 . . . . 0.0 111.665 -175.771 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 6.0 t -62.95 -44.59 95.66 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.103 -179.835 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -148.62 79.9 8.52 Favored Pre-proline 0 N--CA 1.464 0.225 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 179.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -84.73 155.11 11.76 Favored 'Trans proline' 0 N--CA 1.46 -0.454 0 C-N-CA 122.579 2.186 . . . . 0.0 112.104 179.164 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 25.2 p -89.63 169.67 11.12 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.387 175.675 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 9.0 mp -53.28 -27.79 24.57 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 122.818 0.447 . . . . 0.0 112.043 -175.396 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' HIS . . . . . 0.458 ' HD2' ' HB2' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -131.02 44.01 3.02 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.101 0.477 . . . . 0.0 110.118 177.224 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 34.7 t -57.49 -34.47 69.08 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.471 176.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 85.7 m-85 -81.88 14.68 2.59 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.367 -178.322 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -57.83 -44.2 86.32 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 120.831 0.348 . . . . 0.0 110.537 -178.725 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.34 -43.05 96.82 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 121.06 0.457 . . . . 0.0 110.751 177.511 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.68 -37.85 88.92 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.168 178.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . 0.579 HE21 ' HB2' ' A' ' 44' ' ' TRP . 34.3 tt0 -63.7 -45.05 91.74 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.137 178.232 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 36.5 m -57.74 -47.19 83.17 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.358 177.611 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 23.0 mmt180 -52.71 -62.66 1.51 Allowed 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.947 178.297 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' VAL . . . . . 0.443 HG12 ' HB3' ' A' ' 40' ' ' ASN . 80.8 t -60.23 -42.6 90.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.449 -176.118 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 49.9 t80 -56.44 -51.88 66.74 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.095 -178.246 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 5.2 pp0? -73.45 -23.9 60.16 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 116.785 -0.189 . . . . 0.0 111.427 -176.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 61.7 mt -67.61 -49.14 64.5 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.82 0.343 . . . . 0.0 110.235 175.637 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 49.7 mtm -64.34 -36.48 84.27 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 116.158 -0.474 . . . . 0.0 109.886 178.061 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . 0.587 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 44.7 tt0 -55.74 -65.69 0.55 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.631 179.64 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -62.0 -15.64 45.64 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 113.034 0.753 . . . . 0.0 113.034 -171.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -121.84 -61.95 1.45 Allowed 'General case' 0 N--CA 1.466 0.33 0 O-C-N 121.979 -0.45 . . . . 0.0 112.059 -176.002 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 2.6 m -68.74 -39.09 80.5 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.886 -177.018 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' TYR . . . . . 0.587 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 36.1 t80 -78.24 -37.81 44.42 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.986 -173.831 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 21.1 p -61.05 -48.94 79.4 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.219 0.533 . . . . 0.0 110.111 176.342 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 65.5 mtm180 -64.62 -34.33 78.02 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.39 176.236 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -61.27 -37.6 83.75 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.623 177.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 95.4 mt -63.66 -44.93 92.34 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.203 0.525 . . . . 0.0 110.606 177.546 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 23.0 tptp -92.13 5.02 51.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.696 -174.016 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 85.3 p -69.09 141.19 54.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.786 0.327 . . . . 0.0 110.918 178.84 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -56.07 -32.7 64.34 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.042 177.202 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -65.76 -36.86 78.58 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.237 179.592 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -74.44 -38.0 63.12 Favored 'General case' 0 C--O 1.233 0.192 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 177.059 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 95.8 mt -61.75 -28.43 69.43 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.972 175.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -69.4 -41.7 76.08 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.086 173.585 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 98.1 mt -63.41 -25.68 68.39 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.569 178.302 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' MET . . . . . 0.635 ' HA ' ' HE3' ' A' ' 130' ' ' MET . 28.8 mmt -77.64 -54.41 6.42 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.247 175.249 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 54.32 37.37 27.33 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 121.868 0.842 . . . . 0.0 109.677 -178.289 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 102.1 -66.29 0.42 Allowed Glycine 0 N--CA 1.45 -0.388 0 N-CA-C 110.681 -0.968 . . . . 0.0 110.681 -174.468 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' ARG . . . . . 0.527 ' HD2' ' O ' ' A' ' 134' ' ' PRO . 6.8 tmm_? 60.99 111.94 0.02 OUTLIER Pre-proline 0 CA--C 1.539 0.557 0 C-N-CA 123.399 0.68 . . . . 0.0 111.369 174.879 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' PRO . . . . . 0.527 ' O ' ' HD2' ' A' ' 133' ' ' ARG . 75.3 Cg_exo . . . . . 0 C--N 1.354 0.863 0 C-N-CA 123.035 2.49 . . . . 0.0 112.862 179.738 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 2.9 p . . . . . 0 C--O 1.233 0.228 0 CA-C-O 120.823 0.344 . . . . 0.0 110.275 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.1 m -96.19 149.89 36.49 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.046 178.05 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -51.0 -35.54 50.65 Favored 'Trans proline' 0 C--N 1.352 0.715 0 C-N-CA 122.88 2.387 . . . . 0.0 112.364 -179.178 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.53 ' O ' HG22 ' A' ' 9' ' ' VAL . 34.4 tt0 -59.78 -52.0 67.35 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.06 0.457 . . . . 0.0 110.408 176.678 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 32.8 tp10 -56.49 -39.22 72.91 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.641 177.604 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.96 -46.02 86.5 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 115.758 -0.656 . . . . 0.0 111.731 -179.075 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.53 HG22 ' O ' ' A' ' 6' ' ' GLU . 24.7 m -67.16 -28.32 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 CA-C-O 120.931 0.396 . . . . 0.0 110.229 -179.862 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -70.7 -32.05 69.13 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.227 175.725 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 53.2 m0 -66.4 -21.88 66.23 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 173.747 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -83.17 2.15 87.48 Favored Glycine 0 C--N 1.335 0.495 0 CA-C-N 115.707 -0.678 . . . . 0.0 112.915 -179.45 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -125.51 -41.33 2.02 Favored 'General case' 0 C--O 1.234 0.274 0 O-C-N 122.803 -0.234 . . . . 0.0 110.532 176.588 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.435 ' HB2' ' HB3' ' A' ' 17' ' ' LYS . 14.0 m -108.74 101.92 11.01 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 120.842 0.353 . . . . 0.0 110.983 -178.758 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -61.95 -39.7 93.02 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.459 -178.612 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -64.7 -31.63 72.94 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.525 178.826 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.435 ' HB3' ' HB2' ' A' ' 14' ' ' SER . 62.5 tttp -70.5 -35.07 73.01 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 179.633 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.4 tp -62.15 -48.0 82.03 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.025 173.568 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.408 ' O ' ' HB2' ' A' ' 25' ' ' LEU . 60.2 tp -65.93 -49.07 69.26 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.624 -177.831 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 44.1 m -67.33 -29.43 69.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.788 -173.925 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -76.67 119.78 20.95 Favored 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 179.539 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -51.61 -39.19 57.54 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 121.088 0.471 . . . . 0.0 110.632 -176.87 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -66.78 -38.33 86.33 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.12 -179.748 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -71.95 -50.17 19.44 Favored Glycine 0 C--N 1.333 0.382 0 CA-C-N 115.505 -0.77 . . . . 0.0 111.955 -178.754 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.408 ' HB2' ' O ' ' A' ' 19' ' ' LEU . 7.9 tt -52.0 -43.16 63.52 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 122.787 0.435 . . . . 0.0 110.112 175.501 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.495 ' O ' ' HG3' ' A' ' 30' ' ' ARG . 13.6 tp10 -58.12 -56.07 26.79 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.466 178.179 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -60.76 -40.78 93.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.333 -177.281 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 62.8 t80 -69.71 -43.6 72.05 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.785 -175.004 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.422 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 11.6 t -67.9 -41.21 83.04 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 121.075 -0.25 . . . . 0.0 110.732 -178.466 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.495 ' HG3' ' O ' ' A' ' 26' ' ' GLU . 58.7 mtp180 -62.16 -43.22 99.33 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.974 0.416 . . . . 0.0 110.235 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.585 ' O ' HG22 ' A' ' 34' ' ' THR . 87.0 t80 -64.45 -47.13 80.22 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.978 175.816 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.459 HD23 ' HA ' ' A' ' 38' ' ' GLU . 12.2 tp -64.95 -21.83 66.9 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.86 -175.903 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.422 ' HG3' ' O ' ' A' ' 29' ' ' THR . 38.8 mttp -68.06 -29.98 69.08 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.713 178.591 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.585 HG22 ' O ' ' A' ' 31' ' ' PHE . 3.6 t -65.7 -21.93 66.58 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 120.871 0.367 . . . . 0.0 110.647 -177.208 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -118.56 7.44 11.8 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.819 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 56.2 t80 58.24 19.17 5.97 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.864 175.051 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 42.2 m -79.27 0.7 27.65 Favored 'General case' 0 C--N 1.327 -0.384 0 O-C-N 121.985 -0.447 . . . . 0.0 110.636 -178.216 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.47 ' HA ' HG22 ' A' ' 41' ' ' ILE . 7.5 pt-20 -59.26 -22.88 61.8 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.61 176.661 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -53.21 -45.98 68.85 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.665 176.971 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.521 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 91.7 m-20 -64.4 -52.19 59.42 Favored 'General case' 0 C--O 1.241 0.654 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.633 -177.255 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.47 HG22 ' HA ' ' A' ' 38' ' ' GLU . 13.0 tt -61.46 -44.7 99.01 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.155 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.369 -177.259 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.51 ' HA ' ' HB ' ' A' ' 45' ' ' ILE . 40.9 mt-10 -73.26 -21.19 60.66 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.101 -179.779 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.521 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 37.1 t80 -58.16 -60.5 3.66 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 120.614 0.245 . . . . 0.0 110.34 175.27 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.576 ' HB2' ' HG2' ' A' ' 105' ' ' GLN . 47.1 p-90 -75.77 -18.78 59.41 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 119.893 -0.723 . . . . 0.0 111.35 -177.667 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.51 ' HB ' ' HA ' ' A' ' 42' ' ' GLU . 41.4 mt -63.62 -41.51 92.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 169.656 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.07 -31.25 72.02 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.216 175.929 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.496 ' SG ' ' HA ' ' A' ' 44' ' ' TRP . 74.5 m -67.61 -32.73 73.66 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.433 176.812 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 55.0 mm-40 -71.52 -37.02 71.24 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 116.595 -0.275 . . . . 0.0 110.419 175.051 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -65.57 -36.74 84.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.422 0.629 . . . . 0.0 109.406 176.776 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.408 ' CZ ' HG23 ' A' ' 59' ' ' ILE . 50.4 t80 -62.67 -47.05 85.36 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 114.977 -1.01 . . . . 0.0 109.951 172.612 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.97 -22.72 65.88 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 115.386 -0.824 . . . . 0.0 111.163 178.405 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.433 ' HE2' ' HB3' ' A' ' 52' ' ' LYS . 32.4 ttpt -76.8 -18.45 58.41 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.916 -0.583 . . . . 0.0 111.032 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 22.6 t -66.39 159.51 26.78 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 121.11 0.481 . . . . 0.0 111.159 -176.111 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.3 15.95 2.59 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.743 179.089 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -104.13 105.77 2.66 Favored Glycine 0 CA--C 1.518 0.271 0 N-CA-C 111.096 -0.802 . . . . 0.0 111.096 177.022 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -48.58 -50.49 12.27 Favored 'Trans proline' 0 C--N 1.35 0.613 0 C-N-CA 123.017 2.478 . . . . 0.0 112.863 -176.004 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 3.6 pp0? -65.89 -34.52 78.32 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.77 0.319 . . . . 0.0 110.888 177.966 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -68.07 -30.22 69.36 Favored 'General case' 0 N--CA 1.461 0.112 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.934 -179.124 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.408 HG23 ' CZ ' ' A' ' 50' ' ' PHE . 40.8 mm -56.88 -43.56 80.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.199 176.424 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 26.3 m80 -69.65 -42.05 74.74 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.568 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 85.9 mt -64.01 -44.55 92.26 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.802 -179.68 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -66.79 -46.81 74.1 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.552 179.001 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.62 -40.24 91.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.223 -178.914 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 38.2 mmtm -65.72 -37.51 86.61 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.739 178.38 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.8 -53.95 46.41 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.089 0.471 . . . . 0.0 109.963 176.117 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.419 ' HA ' ' HD1' ' A' ' 70' ' ' PHE . 69.9 mt -59.6 -35.05 57.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.366 178.778 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.495 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 40.1 t80 -57.92 -68.13 0.27 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.215 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -67.56 -33.74 75.65 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.446 -173.375 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.488 ' HA ' ' HD2' ' A' ' 76' ' ' PRO . 88.1 tttt -86.58 -29.13 22.85 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.958 -0.565 . . . . 0.0 112.098 -172.544 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' PHE . . . . . 0.419 ' HD1' ' HA ' ' A' ' 66' ' ' ILE . 96.1 m-85 -125.03 -53.4 1.64 Allowed 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -174.556 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.495 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 42.4 mm -64.28 -34.39 68.79 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -169.28 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.431 ' HA ' ' OE1' ' A' ' 72' ' ' GLN . 14.1 mm-40 -58.27 155.86 10.86 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.469 0.652 . . . . 0.0 111.968 -177.513 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.8 t -74.59 -28.65 61.01 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.009 179.233 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -87.51 -82.66 0.22 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.209 175.807 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . 57.19 158.66 0.08 OUTLIER Pre-proline 0 CA--C 1.542 0.636 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 174.714 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.488 ' HD2' ' HA ' ' A' ' 69' ' ' LYS . 64.2 Cg_endo -75.25 -16.34 19.72 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.31 2.006 . . . . 0.0 111.602 170.871 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -105.61 -51.81 2.93 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.418 177.878 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 64.51 93.59 0.06 Allowed 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.299 -175.693 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 65.5 t -86.29 141.92 13.79 Favored 'Isoleucine or valine' 0 C--O 1.237 0.443 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.759 -178.521 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 36.4 m-80 -78.14 23.41 0.28 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.42 -176.777 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 18.0 tp -65.57 142.81 57.97 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.964 177.825 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -48.57 140.11 8.52 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.64 -0.709 . . . . 0.0 112.067 -179.087 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.404 ' O ' ' HG2' ' A' ' 86' ' ' LYS . 84.3 t80 -61.1 -52.89 62.98 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.387 -176.171 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 57.3 t60 -59.43 -38.59 81.08 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.869 0.366 . . . . 0.0 110.641 -177.09 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.431 ' O ' HG13 ' A' ' 89' ' ' ILE . 41.0 m -66.25 -51.62 55.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.76 -179.372 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.558 ' O ' HG23 ' A' ' 90' ' ' THR . 18.1 ptmt -67.29 -25.61 66.13 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.594 -177.64 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -64.08 -52.45 59.25 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-O 121.479 0.657 . . . . 0.0 109.405 175.95 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 99.0 t -58.95 -37.01 64.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.306 177.24 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.431 HG13 ' O ' ' A' ' 85' ' ' THR . 72.8 mt -66.98 -45.04 88.05 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.222 179.365 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.558 HG23 ' O ' ' A' ' 86' ' ' LYS . 48.4 p -57.34 -26.12 60.47 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 120.987 0.423 . . . . 0.0 110.757 -178.712 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -87.8 -41.42 13.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.148 175.987 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 22.5 t -79.51 -0.92 35.3 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.615 -174.977 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.9 tp -74.57 -4.53 5.78 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 CA-C-O 120.848 0.356 . . . . 0.0 111.552 -177.294 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 4.5 t -65.11 -47.18 78.08 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 116.686 -0.234 . . . . 0.0 110.881 179.048 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -132.23 81.35 61.41 Favored Pre-proline 0 N--CA 1.466 0.369 0 CA-C-O 121.161 0.505 . . . . 0.0 110.341 175.676 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_endo -71.43 139.62 35.01 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.746 2.298 . . . . 0.0 112.734 -176.601 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.441 ' H ' ' HB3' ' A' ' 100' ' ' SER . 35.4 p -87.18 172.93 9.55 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.419 173.509 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 41.7 tp -57.79 -36.61 72.42 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 121.189 0.519 . . . . 0.0 110.778 -179.574 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' HIS . . . . . 0.523 ' HB3' ' HB3' ' A' ' 102' ' ' ASP . 46.9 m80 -113.28 38.87 2.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.12 177.174 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' SER . . . . . 0.441 ' HB3' ' H ' ' A' ' 97' ' ' THR . 9.2 p -55.39 -38.78 69.34 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.053 0.454 . . . . 0.0 111.422 -179.833 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 -93.95 21.84 6.29 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.409 -177.342 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' ASP . . . . . 0.523 ' HB3' ' HB3' ' A' ' 99' ' ' HIS . 7.3 p-10 -63.99 -35.29 80.2 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 120.976 0.417 . . . . 0.0 110.192 -179.451 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.494 ' O ' ' HG2' ' A' ' 107' ' ' ARG . . . -63.42 -48.47 77.66 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.887 174.795 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -58.33 -43.1 88.07 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.505 179.276 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.576 ' HG2' ' HB2' ' A' ' 44' ' ' TRP . 0.7 OUTLIER -57.06 -53.16 61.27 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.778 178.397 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 47.4 m -58.47 -48.17 81.64 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.165 -178.793 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' ARG . . . . . 0.494 ' HG2' ' O ' ' A' ' 103' ' ' ALA . 29.9 mmt180 -56.64 -65.05 0.68 Allowed 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.958 0.409 . . . . 0.0 110.886 -178.578 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.421 ' O ' ' HG3' ' A' ' 112' ' ' MET . 63.5 t -58.46 -38.57 70.92 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.4 -174.184 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 86.8 t80 -56.52 -56.6 19.22 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.77 179.052 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.29 -12.89 60.37 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.629 -0.259 . . . . 0.0 111.237 -177.375 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 107' ' ' ARG . 53.4 mt -72.8 -45.56 57.88 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 173.266 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 112' ' ' MET . . . . . 0.421 ' HG3' ' O ' ' A' ' 108' ' ' VAL . 33.6 mtm -61.96 -34.81 76.81 Favored 'General case' 0 CA--C 1.52 -0.191 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 178.428 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 113' ' ' GLU . . . . . 0.564 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 3.9 tm-20 -56.81 -68.76 0.19 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.178 177.544 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -63.75 -19.43 64.95 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.866 -0.607 . . . . 0.0 112.305 -174.127 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -101.14 -71.33 0.71 Allowed 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 120.991 0.424 . . . . 0.0 111.523 -179.049 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 7.4 m -79.4 -33.54 42.64 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.068 -0.515 . . . . 0.0 112.136 -171.335 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' TYR . . . . . 0.564 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 41.4 t80 -75.24 -30.9 60.65 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.662 0.268 . . . . 0.0 110.773 -173.235 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 32.8 p -64.16 -56.21 16.38 Favored 'General case' 0 C--O 1.24 0.598 0 CA-C-O 120.991 0.424 . . . . 0.0 110.642 177.751 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 9.4 ptp85 -60.81 -32.48 71.84 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.021 177.947 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -60.77 -40.29 91.98 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.538 177.562 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 92.5 mt -71.62 -26.92 62.77 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.746 -178.318 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 16.4 tppt? -106.75 7.05 30.18 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 120.966 0.413 . . . . 0.0 111.342 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 86.9 p -74.8 156.61 36.33 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 110.249 -0.278 . . . . 0.0 110.249 178.454 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -58.74 -24.67 62.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.164 175.064 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 50.8 mm -61.92 -56.53 17.12 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.576 178.629 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 66.3 t80 -72.34 -37.75 68.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.548 -177.916 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 80.8 mt -63.81 -30.16 71.28 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.299 177.653 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -66.65 -38.73 87.48 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.091 174.462 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 98.8 mt -66.03 -28.59 68.98 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.301 176.069 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 130' ' ' MET . . . . . . . . . . . . . 26.6 mmt . . . . . 0 C--O 1.234 0.243 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.732 179.187 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 13.3 p . . . . . 0 C--O 1.235 0.29 0 CA-C-O 120.79 0.329 . . . . 0.0 110.35 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.7 m -66.11 135.62 95.16 Favored Pre-proline 0 CA--C 1.535 0.387 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.261 175.391 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -49.01 -29.58 16.01 Favored 'Trans proline' 0 C--N 1.354 0.864 0 C-N-CA 123.038 2.492 . . . . 0.0 112.281 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -52.61 -59.96 3.83 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.748 177.746 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.54 ' HA ' ' HB3' ' A' ' 10' ' ' LYS . 25.5 tt0 -79.82 -22.67 42.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.823 -177.614 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -56.9 -46.49 81.9 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 120.87 0.367 . . . . 0.0 110.304 176.827 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 33.7 m -76.16 -29.04 19.01 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.382 177.119 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.54 ' HB3' ' HA ' ' A' ' 7' ' ' GLU . 16.2 tppt? -65.08 -27.51 68.82 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.808 176.606 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 43.6 m0 -65.96 -27.52 68.22 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 120.682 0.277 . . . . 0.0 110.615 175.477 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -61.6 -12.55 34.23 Favored Glycine 0 CA--C 1.52 0.371 0 CA-C-N 115.728 -0.669 . . . . 0.0 114.209 -173.047 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.486 ' HG2' ' O ' ' A' ' 10' ' ' LYS . 12.0 pt-20 -104.36 -14.85 15.61 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 117.367 0.583 . . . . 0.0 111.901 -178.605 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.549 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 19.3 m -145.21 95.03 2.61 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-O 120.987 0.423 . . . . 0.0 111.901 -173.339 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.463 ' O ' ' HB3' ' A' ' 18' ' ' LEU . 15.9 t80 -54.86 -32.24 60.53 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.377 0.608 . . . . 0.0 109.884 175.122 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -57.15 -50.37 73.04 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.425 176.92 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.549 ' HG2' ' O ' ' A' ' 14' ' ' SER . 13.0 ptmm? -69.99 -22.86 63.09 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 120.81 -0.356 . . . . 0.0 110.081 -175.865 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.463 ' HB3' ' O ' ' A' ' 15' ' ' PHE . 62.8 tp -59.55 -54.7 43.47 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.917 174.921 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -68.44 -34.72 76.49 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.655 177.83 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.458 ' HB3' ' HA ' ' A' ' 17' ' ' LYS . 23.9 t -64.43 -25.09 67.86 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.508 179.376 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 16.2 t-80 -88.84 113.66 24.63 Favored 'General case' 0 C--O 1.223 -0.29 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 177.565 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 8.4 ptm180 -47.23 -45.27 23.38 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-O 120.782 0.325 . . . . 0.0 111.601 -176.455 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -67.59 -34.46 77.06 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.068 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -72.37 -41.67 51.67 Favored Glycine 0 C--N 1.331 0.282 0 N-CA-C 111.396 -0.682 . . . . 0.0 111.396 -179.194 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 7.3 tt -60.0 -41.85 93.0 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 174.488 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.457 ' O ' HG22 ' A' ' 29' ' ' THR . 30.2 tt0 -60.3 -55.5 32.95 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.77 176.676 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -56.75 -43.85 81.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.332 -178.301 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 80.2 t80 -68.45 -43.33 77.3 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.06 -176.766 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.457 HG22 ' O ' ' A' ' 26' ' ' GLU . 12.5 t -67.04 -35.7 80.47 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 120.665 -0.414 . . . . 0.0 110.083 -179.439 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.453 ' HG3' ' O ' ' A' ' 26' ' ' GLU . 43.4 mtp180 -64.74 -45.46 86.38 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 121.085 0.469 . . . . 0.0 109.753 176.23 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 80.1 t80 -62.43 -42.04 99.17 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.565 177.316 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.437 ' HA ' ' HB3' ' A' ' 35' ' ' GLU . 16.2 tp -75.42 -22.09 57.66 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.501 -176.438 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.531 ' HE2' ' HG3' ' A' ' 38' ' ' GLU . 1.5 mptm? -71.68 -47.26 55.36 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.013 174.31 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 14.5 t -73.46 -18.3 61.14 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 120.854 0.359 . . . . 0.0 110.085 177.538 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.437 ' HB3' ' HA ' ' A' ' 32' ' ' LEU . 10.2 tp10 -75.11 -25.05 58.2 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.318 171.445 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 33.9 t80 68.39 33.57 4.09 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.128 177.455 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.1 m -136.43 30.46 2.92 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.553 -178.738 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.531 ' HG3' ' HE2' ' A' ' 33' ' ' LYS . 0.1 OUTLIER -70.52 -11.49 60.96 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.009 -0.542 . . . . 0.0 111.193 -177.91 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -45.25 -37.32 4.58 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.275 176.372 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.621 HD21 ' HB2' ' A' ' 80' ' ' ASN . 4.4 m-20 -69.36 -50.54 45.26 Favored 'General case' 0 C--O 1.242 0.662 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.896 -178.671 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.471 HG22 ' O ' ' A' ' 38' ' ' GLU . 11.2 tt -64.83 -42.92 96.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 C-N-CA 121.021 -0.272 . . . . 0.0 110.281 -175.215 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.42 ' HA ' ' HB ' ' A' ' 45' ' ' ILE . 51.8 mt-10 -69.22 -25.36 64.27 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.433 -0.348 . . . . 0.0 110.482 178.783 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.502 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 78.1 t80 -57.54 -60.9 2.96 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.726 178.38 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.731 ' HA ' ' SG ' ' A' ' 47' ' ' CYS . 43.1 p-90 -78.78 -17.01 56.44 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 119.779 -0.769 . . . . 0.0 111.82 -178.336 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.42 ' HB ' ' HA ' ' A' ' 42' ' ' GLU . 30.7 mt -63.85 -38.51 82.53 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 168.268 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.71 -34.69 67.3 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.1 178.474 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.731 ' SG ' ' HA ' ' A' ' 44' ' ' TRP . 18.2 p -72.25 -23.67 61.25 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-O 120.562 0.22 . . . . 0.0 110.502 -179.252 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -67.97 -52.46 35.72 Favored 'General case' 0 CA--C 1.521 -0.139 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 170.912 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -55.92 -27.72 53.55 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.795 -0.638 . . . . 0.0 110.311 175.904 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.559 ' HA ' ' HD2' ' A' ' 62' ' ' LYS . 49.9 t80 -69.62 -50.35 45.23 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.991 178.052 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 64.8 pttt -72.52 -21.14 61.23 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 121.252 0.548 . . . . 0.0 110.157 178.684 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -74.68 -38.32 62.43 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.959 -176.95 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.8 p -63.24 128.68 36.93 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.905 0.383 . . . . 0.0 110.319 176.431 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -102.35 -1.75 30.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.206 -174.694 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -88.38 115.1 4.34 Favored Glycine 0 CA--C 1.521 0.457 0 C-N-CA 121.109 -0.567 . . . . 0.0 111.848 177.677 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -53.69 -33.84 71.45 Favored 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 122.886 2.391 . . . . 0.0 112.374 -178.901 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 58.2 mt-30 -65.47 -49.26 69.74 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.598 178.355 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -59.2 -38.53 80.12 Favored 'General case' 0 N--CA 1.461 0.109 0 CA-C-N 115.0 -1.0 . . . . 0.0 110.534 179.617 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.425 ' O ' ' HE1' ' A' ' 50' ' ' PHE . 43.1 mm -54.38 -53.83 26.93 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.039 178.954 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.494 ' HA ' ' HG2' ' A' ' 96' ' ' PRO . 20.0 m80 -63.39 -46.95 84.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.317 -176.325 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 88.8 mt -67.52 -44.05 79.33 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.114 -176.463 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.559 ' HD2' ' HA ' ' A' ' 50' ' ' PHE . 40.1 ttmt -64.17 -41.01 97.3 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.543 -178.819 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.26 -41.1 92.54 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.416 178.122 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 65.5 tttm -65.88 -38.06 87.79 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.128 178.597 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.18 -52.14 64.98 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.385 176.623 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 75.4 mt -59.34 -35.99 61.38 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 CA-C-O 121.257 0.551 . . . . 0.0 110.014 178.136 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 90.2 t80 -58.43 -60.95 2.99 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.58 178.448 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -70.19 -18.21 63.18 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.886 -174.795 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 85.4 tttt -97.24 -28.76 13.93 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 111.887 0.328 . . . . 0.0 111.887 -174.509 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 70.9 m-85 -130.83 -46.45 1.04 Allowed 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 -173.821 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 48.0 mm -74.51 -34.2 34.89 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 CA-C-O 121.085 0.469 . . . . 0.0 111.392 -173.296 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.414 ' OE1' ' HB3' ' A' ' 74' ' ' ASP . 0.0 OUTLIER -61.39 137.47 58.24 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.328 -174.386 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 22.9 m -66.01 -24.22 66.72 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 121.387 0.613 . . . . 0.0 109.67 174.902 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ASP . . . . . 0.414 ' HB3' ' OE1' ' A' ' 72' ' ' GLN . 20.8 t70 -106.05 86.26 2.34 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 169.763 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -137.95 152.49 72.25 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.122 -179.517 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_exo -46.8 -48.81 13.4 Favored 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 123.124 2.55 . . . . 0.0 112.857 -178.922 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.429 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 94.0 mttt -116.32 -37.0 3.86 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.219 178.755 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.429 ' HB2' ' O ' ' A' ' 77' ' ' LYS . 44.0 mt-10 66.49 -177.47 0.2 Allowed 'General case' 0 C--O 1.234 0.279 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 -164.024 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.429 HG21 ' HD1' ' A' ' 43' ' ' PHE . 69.4 t -144.32 141.17 24.39 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 N-CA-C 110.339 -0.245 . . . . 0.0 110.339 177.463 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.621 ' HB2' HD21 ' A' ' 40' ' ' ASN . 34.7 m-80 -64.66 80.91 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.049 176.942 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 36.6 tp -127.5 143.73 51.15 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.432 -0.803 . . . . 0.0 109.741 179.011 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -50.38 132.2 24.62 Favored 'General case' 0 N--CA 1.466 0.371 0 O-C-N 123.427 0.454 . . . . 0.0 111.193 177.84 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -62.55 -38.2 89.13 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.911 -177.433 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' HIS . . . . . 0.468 ' O ' HG23 ' A' ' 88' ' ' VAL . 84.7 t60 -65.41 -36.94 85.47 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 179.005 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 48.3 m -66.38 -41.39 89.46 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.127 175.894 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -60.95 -41.37 96.18 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 175.996 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -57.66 -44.1 85.46 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.656 178.922 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.468 HG23 ' O ' ' A' ' 84' ' ' HIS . 99.4 t -56.93 -44.74 82.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.114 176.203 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 71.8 mt -70.23 -38.19 73.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.321 -177.224 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 41.7 p -65.05 -26.67 68.35 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 120.682 0.277 . . . . 0.0 111.063 -177.945 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 47.8 m-80 -86.31 -46.05 10.67 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.897 175.79 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 21.8 m -82.01 -3.61 54.88 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 -173.72 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 7.9 tp -56.38 -23.07 15.82 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 CA-C-O 120.975 0.417 . . . . 0.0 111.342 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 11.6 t -64.1 -33.64 76.22 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.417 -179.081 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 17.2 mm-40 -140.5 76.64 24.72 Favored Pre-proline 0 N--CA 1.466 0.34 0 CA-C-O 120.748 0.309 . . . . 0.0 110.251 -178.864 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' PRO . . . . . 0.494 ' HG2' ' HA ' ' A' ' 60' ' ' HIS . 72.0 Cg_endo -76.97 138.26 18.26 Favored 'Trans proline' 0 CA--C 1.531 0.371 0 C-N-CA 122.538 2.159 . . . . 0.0 112.085 179.776 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 5.8 m -105.82 162.72 13.3 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.422 -179.091 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.567 ' H ' HD22 ' A' ' 98' ' ' LEU . 3.9 mm? -15.75 -57.87 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 125.037 1.335 . . . . 0.0 114.006 -177.962 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 16.2 t-80 -146.23 35.83 1.0 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.874 -1.057 . . . . 0.0 109.593 -163.25 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 25.0 t -61.0 -10.99 6.68 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 114.973 -1.012 . . . . 0.0 112.071 -175.81 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 81.6 m-85 -87.34 14.64 7.59 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.805 -0.179 . . . . 0.0 111.221 178.289 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -59.01 -44.53 91.71 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 120.823 0.344 . . . . 0.0 110.811 -179.33 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.91 -42.07 97.33 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 121.221 0.534 . . . . 0.0 110.379 177.905 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.54 -39.34 91.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.631 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -60.47 -44.23 96.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.216 178.908 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 36.6 t -58.93 -52.12 67.1 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.326 178.191 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' ARG . . . . . 0.441 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 19.4 mmt180 -54.54 -61.37 2.35 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.159 -179.573 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.447 HG21 ' CD2' ' A' ' 43' ' ' PHE . 59.2 t -57.94 -46.43 87.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.569 -0.742 . . . . 0.0 112.052 -173.785 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 68.3 t80 -57.71 -52.72 64.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.983 -178.384 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' GLN . . . . . 0.441 ' HG3' ' O ' ' A' ' 107' ' ' ARG . 4.7 pp0? -71.93 -31.76 66.67 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.929 0.395 . . . . 0.0 110.887 -176.381 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 31.9 tp -68.94 -38.5 79.53 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.952 -175.109 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' MET . . . . . 0.483 ' HB3' HD22 ' A' ' 40' ' ' ASN . 24.4 ptt? -82.4 -22.25 35.46 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 176.709 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 113' ' ' GLU . . . . . 0.689 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 37.2 tt0 -61.82 -59.61 4.88 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.141 178.27 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -49.14 -35.42 16.52 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.195 -176.816 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -104.92 -65.93 1.01 Allowed 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 -175.463 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 33.3 t -63.92 -36.57 84.38 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 111.698 0.258 . . . . 0.0 111.698 -173.139 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' TYR . . . . . 0.689 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 15.5 t80 -70.0 -40.23 75.41 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 120.453 0.168 . . . . 0.0 110.925 -177.867 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 28.8 p -65.63 -44.26 87.01 Favored 'General case' 0 C--O 1.241 0.648 0 CA-C-O 121.186 0.517 . . . . 0.0 109.966 176.27 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 75.1 mtp85 -57.24 -40.15 77.01 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.077 174.892 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -61.43 -40.76 95.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.095 176.81 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 89.8 mt -68.88 -8.96 48.88 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.202 179.286 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 122' ' ' LYS . . . . . 0.463 ' HD3' ' HA ' ' A' ' 122' ' ' LYS . 0.1 OUTLIER -130.65 20.32 5.11 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 120.917 0.389 . . . . 0.0 111.44 173.608 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 89.1 p -65.92 161.93 20.21 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.949 176.928 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 15.5 p-10 -62.76 -43.66 98.21 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.354 -179.49 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.404 ' O ' ' HG ' ' A' ' 129' ' ' LEU . 7.7 tp -62.61 -39.22 83.81 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.607 178.338 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 126' ' ' TYR . . . . . 0.443 ' O ' ' HG2' ' A' ' 130' ' ' MET . 58.0 t80 -66.8 -40.43 88.08 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 110.131 -0.322 . . . . 0.0 110.131 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 83.3 mt -61.74 -37.18 83.27 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.311 177.151 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -62.66 -43.17 99.5 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.188 175.153 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' A' ' 125' ' ' ILE . 95.1 mt -63.73 -30.0 71.15 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.606 176.931 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 130' ' ' MET . . . . . 0.443 ' HG2' ' O ' ' A' ' 126' ' ' TYR . 21.4 mmt . . . . . 0 N--CA 1.464 0.257 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.619 177.74 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.7 p . . . . . 0 C--O 1.233 0.193 0 CA-C-O 120.785 0.326 . . . . 0.0 110.319 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 34.8 t -88.91 148.11 40.51 Favored Pre-proline 0 C--N 1.327 -0.404 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 177.052 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_endo -48.62 -33.24 23.52 Favored 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 122.839 2.359 . . . . 0.0 111.869 179.286 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.567 ' O ' HG22 ' A' ' 9' ' ' VAL . 36.3 mt-10 -63.14 -54.16 42.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.143 178.035 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -63.3 -29.29 70.64 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.081 0.467 . . . . 0.0 109.959 178.03 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.22 -40.04 82.2 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.358 -179.348 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.567 HG22 ' O ' ' A' ' 6' ' ' GLU . 25.5 m -71.51 -21.92 21.75 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.269 0 C-N-CA 120.489 -0.484 . . . . 0.0 110.024 177.347 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.596 ' O ' ' HG2' ' A' ' 13' ' ' GLU . 5.6 mptp? -69.52 -16.37 63.42 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.852 173.186 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 42.8 m0 -80.3 -16.46 54.58 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.767 -0.456 . . . . 0.0 109.767 174.47 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -96.02 13.69 65.66 Favored Glycine 0 C--N 1.334 0.45 0 CA-C-N 115.708 -0.678 . . . . 0.0 112.858 -178.636 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.596 ' HG2' ' O ' ' A' ' 10' ' ' LYS . 11.5 pt-20 -111.78 -28.38 8.11 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 120.881 0.372 . . . . 0.0 110.457 175.708 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.8 m -152.6 117.51 5.12 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.322 -177.032 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 12.3 t80 -56.58 -36.84 69.8 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 172.223 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -52.19 -45.2 65.09 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 115.069 -0.969 . . . . 0.0 110.858 175.794 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.554 ' HD2' ' O ' ' A' ' 10' ' ' LYS . 40.4 ttmt -70.19 -36.29 74.52 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.301 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 67.3 tp -58.82 -43.41 90.64 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.078 176.259 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 51.5 tp -74.02 -34.71 64.22 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.574 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 33.6 t -63.81 -28.94 70.21 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.533 179.168 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.449 ' HB3' ' H ' ' A' ' 24' ' ' GLY . 1.5 m-70 -84.49 115.64 22.68 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 175.783 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.63 ' NH1' ' HB3' ' A' ' 22' ' ' ARG . 4.6 ttp-105 -56.49 -31.63 64.23 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 176.438 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -64.06 -46.71 83.16 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.397 176.38 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.449 ' H ' ' HB3' ' A' ' 21' ' ' HIS . . . -62.93 -44.62 97.14 Favored Glycine 0 N--CA 1.45 -0.393 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.658 179.309 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 13.3 tp -52.36 -57.39 9.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.144 0.497 . . . . 0.0 110.475 174.651 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -58.74 -39.49 81.04 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-N 115.25 -0.886 . . . . 0.0 111.199 -175.434 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -71.4 -45.47 62.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.022 0.439 . . . . 0.0 110.976 179.017 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.478 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 74.2 t80 -72.98 -30.28 63.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.226 -174.876 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 13.6 t -76.02 -39.09 56.44 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 -177.748 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 37.2 ttt180 -59.72 -39.37 84.45 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.905 171.924 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.512 ' O ' HG22 ' A' ' 34' ' ' THR . 68.0 t80 -62.59 -53.45 54.39 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.822 -178.502 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.599 HD13 ' HA ' ' A' ' 38' ' ' GLU . 2.7 pp -73.91 -16.12 61.11 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 120.761 0.315 . . . . 0.0 111.406 -179.493 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.616 ' HD2' ' HB3' ' A' ' 38' ' ' GLU . 12.7 mptt -65.38 -50.23 66.32 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 120.962 0.41 . . . . 0.0 110.086 175.785 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.512 HG22 ' O ' ' A' ' 31' ' ' PHE . 13.8 t -68.66 -17.96 64.19 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.885 -174.262 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.557 ' HG2' ' HA ' ' A' ' 32' ' ' LEU . 12.5 pt-20 -97.56 8.76 44.05 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.736 0.303 . . . . 0.0 110.631 176.974 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 91.7 m-85 57.96 39.58 26.42 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.727 173.945 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 26.1 m -124.81 34.59 4.96 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.446 0.641 . . . . 0.0 109.3 177.179 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.616 ' HB3' ' HD2' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -83.43 -30.75 27.06 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.13 -0.941 . . . . 0.0 112.857 -170.079 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.437 ' HB3' ' NZ ' ' A' ' 77' ' ' LYS . 0.4 OUTLIER -57.71 -22.25 45.27 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 120.823 -0.351 . . . . 0.0 110.9 -177.058 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.538 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 58.1 m-80 -66.74 -50.46 62.69 Favored 'General case' 0 C--O 1.239 0.514 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.435 179.06 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.431 HG22 ' O ' ' A' ' 38' ' ' GLU . 13.9 tt -69.38 -40.67 80.31 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 C-N-CA 120.916 -0.314 . . . . 0.0 110.191 -178.751 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -61.69 -30.94 71.07 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.404 175.128 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.538 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 78.4 t80 -59.87 -66.58 0.49 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.405 179.603 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.643 ' HB2' ' HG3' ' A' ' 105' ' ' GLN . 47.2 p-90 -75.55 -18.5 59.75 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 120.176 -0.61 . . . . 0.0 112.516 -171.9 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 13.0 tt -73.39 -32.8 38.42 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 173.738 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.56 -27.69 65.34 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.927 -0.578 . . . . 0.0 109.904 174.346 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.506 ' SG ' ' HB2' ' A' ' 101' ' ' PHE . 41.4 t -68.83 -42.96 76.49 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.181 175.134 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 18.2 tp10 -65.1 -36.95 85.92 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 176.317 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.595 ' HA ' ' HE3' ' A' ' 52' ' ' LYS . 10.4 t70 -64.9 -38.26 90.38 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.378 173.995 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.491 ' HA ' ' HE2' ' A' ' 62' ' ' LYS . 8.5 t80 -56.15 -39.89 73.01 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.626 177.375 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.599 ' HB2' ' NZ ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -97.47 -5.28 36.37 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.826 0.676 . . . . 0.0 112.826 -173.656 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.595 ' HE3' ' HA ' ' A' ' 49' ' ' ASP . 18.4 ptpt -74.38 -28.4 61.09 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 175.267 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.2 p -74.24 150.5 40.26 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.982 174.829 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.64 4.7 5.54 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 111.678 0.251 . . . . 0.0 111.678 -177.955 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' GLY . . . . . 0.494 ' O ' HG12 ' A' ' 59' ' ' ILE . . . -75.12 120.44 6.2 Favored Glycine 0 CA--C 1.52 0.372 0 N-CA-C 111.169 -0.772 . . . . 0.0 111.169 175.652 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_exo -49.0 -62.3 0.45 Allowed 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 122.878 2.386 . . . . 0.0 112.777 -175.498 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.83 -34.52 74.68 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 120.903 0.382 . . . . 0.0 110.519 -179.224 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -60.65 -41.39 94.91 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.955 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.494 HG12 ' O ' ' A' ' 55' ' ' GLY . 44.2 mm -59.0 -41.44 83.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.683 179.096 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 79.1 m80 -64.95 -50.46 66.3 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.443 -177.237 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.458 HD12 ' N ' ' A' ' 62' ' ' LYS . 4.4 pp -70.54 -31.02 67.92 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.476 -175.309 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.491 ' HE2' ' HA ' ' A' ' 50' ' ' PHE . 60.5 mtpt -71.93 -41.73 67.49 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 120.777 0.323 . . . . 0.0 110.299 176.82 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.475 ' HB2' ' CE1' ' A' ' 50' ' ' PHE . . . -60.85 -44.69 96.67 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.691 178.427 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -65.51 -41.12 93.52 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.629 -177.82 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.99 -50.54 73.7 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-O 121.067 0.46 . . . . 0.0 110.567 177.864 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 70.1 mt -62.57 -38.19 80.85 Favored 'Isoleucine or valine' 0 C--O 1.231 0.127 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.327 178.961 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.577 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 49.1 t80 -55.74 -59.84 4.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.635 178.073 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -67.55 -24.61 65.55 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.427 -0.806 . . . . 0.0 112.603 -170.543 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -105.49 -25.41 12.34 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -176.051 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' PHE . . . . . 0.529 ' HB3' ' HD1' ' A' ' 43' ' ' PHE . 96.4 m-85 -125.04 -46.12 1.83 Allowed 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 112.678 0.622 . . . . 0.0 112.678 -171.725 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.577 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 48.4 mm -71.04 -37.93 69.62 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 CA-C-O 120.944 0.402 . . . . 0.0 110.647 -173.473 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.405 ' OE1' ' HA ' ' A' ' 72' ' ' GLN . 5.8 tp60 -72.64 129.41 38.19 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.227 179.397 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 27.2 m -60.17 -44.1 95.31 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.204 0.526 . . . . 0.0 110.103 178.077 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -74.82 79.33 2.1 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.152 175.254 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -132.3 156.82 79.64 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.727 -175.588 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -67.74 -30.32 34.34 Favored 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 122.704 2.269 . . . . 0.0 112.259 -179.178 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.437 ' NZ ' ' HB3' ' A' ' 39' ' ' GLU . 26.0 tptp -105.0 -39.4 6.26 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.981 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.436 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 51.5 mt-10 69.3 154.27 0.11 Allowed 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.297 -177.377 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.433 HG21 ' CD1' ' A' ' 43' ' ' PHE . 88.2 t -140.05 147.86 23.25 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.496 175.603 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 83.6 m-20 -86.79 87.75 7.52 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.122 0.487 . . . . 0.0 109.97 178.735 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.495 HD11 HG21 ' A' ' 85' ' ' THR . 37.3 tp -134.86 145.67 48.51 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.79 -177.853 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -54.73 158.9 2.42 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-N 115.683 -0.69 . . . . 0.0 112.487 -177.814 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 55.7 m-85 -73.69 -57.25 4.11 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.79 -177.874 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' HIS . . . . . 0.447 ' O ' HG23 ' A' ' 88' ' ' VAL . 86.3 t60 -64.27 -31.03 72.08 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.996 -175.977 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.495 HG21 HD11 ' A' ' 81' ' ' LEU . 76.0 m -59.61 -51.76 68.43 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.67 179.205 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 9.7 ptpp? -71.24 -25.27 62.41 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.263 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -63.53 -41.64 98.47 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 121.231 0.539 . . . . 0.0 110.233 176.047 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 84' ' ' HIS . 81.3 t -64.06 -37.97 81.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 121.25 0.547 . . . . 0.0 109.66 174.943 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 75.6 mt -66.14 -40.3 86.71 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.258 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.424 ' O ' HG22 ' A' ' 93' ' ' ILE . 40.2 p -61.78 -36.13 80.16 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 120.991 0.424 . . . . 0.0 110.376 179.483 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 28.7 m-80 -73.68 -29.23 62.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.903 175.316 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 50.5 m -94.8 -2.7 50.39 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -175.593 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.424 HG22 ' O ' ' A' ' 90' ' ' THR . 9.9 tp -61.35 -27.58 42.18 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.384 0 CA-C-O 120.874 0.369 . . . . 0.0 110.924 -177.269 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 15.0 t -78.97 -18.29 53.98 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.099 -178.633 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 80.6 mm-40 -140.58 75.66 26.01 Favored Pre-proline 0 N--CA 1.465 0.313 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.28 -179.614 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -75.08 143.07 28.36 Favored 'Trans proline' 0 C--O 1.236 0.377 0 C-N-CA 122.398 2.065 . . . . 0.0 111.688 178.391 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.495 HG22 ' H ' ' A' ' 98' ' ' LEU . 3.4 m -130.09 168.43 16.78 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 -178.701 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.495 ' H ' HG22 ' A' ' 97' ' ' THR . 3.2 mm? -64.71 3.73 0.49 Allowed 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 -170.119 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -157.14 19.72 0.3 Allowed 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 118.485 0.584 . . . . 0.0 111.854 174.301 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 30.0 m -55.21 -37.1 66.69 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 121.035 0.445 . . . . 0.0 111.789 -178.071 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.506 ' HB2' ' SG ' ' A' ' 47' ' ' CYS . 10.7 m-85 -89.79 16.89 7.27 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.519 -175.416 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -69.83 -32.96 71.67 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 120.85 0.357 . . . . 0.0 110.51 -177.606 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.9 -43.94 97.82 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 121.188 0.518 . . . . 0.0 109.943 176.148 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.13 -42.72 96.71 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.033 177.146 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.643 ' HG3' ' HB2' ' A' ' 44' ' ' TRP . 57.4 tt0 -57.34 -42.7 82.46 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.406 177.721 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 46.7 t -63.17 -53.22 56.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.996 -179.577 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' ARG . . . . . 0.436 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 20.0 mmm180 -57.21 -44.81 84.04 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.86 -174.342 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 57.7 t -77.26 -37.32 25.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.144 -175.851 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -60.57 -52.35 65.55 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.595 176.808 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' GLN . . . . . 0.436 ' HG3' ' O ' ' A' ' 107' ' ' ARG . 5.0 pp0? -64.53 -31.31 72.47 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.064 0.459 . . . . 0.0 110.298 -178.745 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.414 ' HB2' ' O ' ' A' ' 107' ' ' ARG . 31.7 tp -65.74 -44.01 87.25 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.831 -176.579 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 28.1 mtm -72.49 -34.53 67.74 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 177.157 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' GLU . . . . . 0.602 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 7.1 tm-20 -57.56 -63.3 1.28 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.552 -178.328 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -54.8 -26.04 32.18 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.115 -0.493 . . . . 0.0 112.128 -174.879 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -103.66 -74.26 0.65 Allowed 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 120.803 0.335 . . . . 0.0 111.795 -176.459 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 15.6 t -64.84 -31.94 73.41 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.923 -170.442 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' TYR . . . . . 0.602 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 38.3 t80 -63.85 -40.88 97.6 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.617 0.246 . . . . 0.0 111.051 -176.743 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 63.5 p -61.72 -45.92 91.87 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-O 121.536 0.684 . . . . 0.0 109.965 179.177 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 52.8 mtp180 -59.58 -41.27 89.87 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.145 176.88 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 77.6 t80 -59.53 -34.2 72.34 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.46 179.576 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 94.5 mt -71.05 -26.01 62.9 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.161 178.935 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -115.89 21.43 13.82 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.393 177.706 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 97.9 p -75.7 152.21 37.53 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 120.645 0.26 . . . . 0.0 110.785 179.496 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -61.48 -29.14 69.78 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.353 0.597 . . . . 0.0 109.4 176.038 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.427 ' O ' ' HG ' ' A' ' 129' ' ' LEU . 45.2 mm -61.24 -52.93 55.69 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 115.087 -0.96 . . . . 0.0 110.21 174.343 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 126' ' ' TYR . . . . . 0.433 ' O ' ' HG2' ' A' ' 130' ' ' MET . 53.0 t80 -62.73 -38.74 91.68 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.587 -177.963 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 97.7 mt -60.77 -33.69 73.34 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.323 177.538 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -74.65 -34.3 62.7 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.373 177.192 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 125' ' ' ILE . 85.7 mt -71.26 -18.24 62.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.61 178.275 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 130' ' ' MET . . . . . 0.433 ' HG2' ' O ' ' A' ' 126' ' ' TYR . 21.6 mmt . . . . . 0 CA--C 1.533 0.321 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.913 178.634 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.446 HG21 ' CZ2' ' A' ' 11' ' ' TRP . 7.1 p . . . . . 0 C--O 1.235 0.333 0 CA-C-O 120.88 0.371 . . . . 0.0 111.502 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.7 m -76.83 151.54 82.32 Favored Pre-proline 0 C--O 1.236 0.362 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.334 176.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -53.59 -34.89 75.1 Favored 'Trans proline' 0 C--N 1.351 0.67 0 C-N-CA 122.877 2.385 . . . . 0.0 112.652 -177.192 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 46.3 mm-40 -60.48 -52.87 63.35 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.966 -179.505 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.533 ' HA ' ' HE2' ' A' ' 10' ' ' LYS . 22.1 tp10 -65.27 -37.8 88.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.074 178.565 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.07 -53.56 57.0 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.232 -179.554 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.797 HG12 ' SD ' ' A' ' 130' ' ' MET . 22.9 m -66.94 -25.55 34.68 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-O 121.26 0.553 . . . . 0.0 110.572 -179.589 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.551 ' HG2' ' HE2' ' A' ' 17' ' ' LYS . 35.2 ttpt -76.14 -9.52 58.69 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.396 -175.618 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.446 ' CZ2' HG21 ' A' ' 3' ' ' VAL . 45.9 m0 -66.98 -18.22 65.28 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.419 0.152 . . . . 0.0 111.1 177.773 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -76.26 60.87 3.13 Favored Glycine 0 C--N 1.333 0.374 0 CA-C-N 116.098 -0.501 . . . . 0.0 112.829 -177.617 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -150.74 -39.41 0.13 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.0 0.429 . . . . 0.0 110.34 176.322 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.413 ' HB3' ' OD1' ' A' ' 16' ' ' ASP . 69.3 m -142.1 125.08 16.17 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.678 -176.649 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.403 ' CZ ' ' SD ' ' A' ' 112' ' ' MET . 33.9 t80 -58.95 -40.21 84.01 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.028 178.489 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.413 ' OD1' ' HB3' ' A' ' 14' ' ' SER . 7.9 p-10 -64.66 -29.74 70.75 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.641 -0.708 . . . . 0.0 110.862 179.509 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.551 ' HE2' ' HG2' ' A' ' 10' ' ' LYS . 65.7 tttp -65.87 -38.22 88.21 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 121.163 0.506 . . . . 0.0 109.828 176.84 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.455 HD21 ' HB2' ' A' ' 28' ' ' PHE . 54.5 tp -59.91 -48.05 83.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.248 176.467 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -72.55 -25.56 61.4 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.178 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 30.2 t -60.02 -27.73 67.15 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 121.326 0.584 . . . . 0.0 109.572 176.119 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 71.5 m-70 -100.46 118.9 37.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.52 176.272 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 92.4 mtt180 -64.48 -27.34 68.92 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.87 0.367 . . . . 0.0 110.083 179.596 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -65.21 -41.28 94.63 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.861 172.546 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -67.7 -45.73 73.62 Favored Glycine 0 C--N 1.331 0.274 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.522 178.479 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 7.7 tt -54.74 -42.6 71.8 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.166 -0.517 . . . . 0.0 110.003 175.457 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.487 ' O ' ' HG2' ' A' ' 30' ' ' ARG . 19.2 tp10 -58.03 -53.77 54.46 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.267 178.849 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -61.14 -40.2 92.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.262 -178.122 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.455 ' HB2' HD21 ' A' ' 18' ' ' LEU . 80.9 t80 -68.47 -48.7 63.82 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.201 -176.804 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.8 t -61.61 -34.51 75.78 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-O 120.72 0.295 . . . . 0.0 110.339 -177.44 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.487 ' HG2' ' O ' ' A' ' 26' ' ' GLU . 26.5 mmt180 -59.38 -52.0 67.49 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.335 176.844 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -64.35 -42.23 96.33 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.669 179.054 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.407 HD22 ' CE2' ' A' ' 28' ' ' PHE . 13.7 tp -65.55 -27.62 68.57 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.582 -176.036 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.563 ' HG2' ' HB3' ' A' ' 38' ' ' GLU . 56.9 mttm -75.13 -43.93 49.88 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.082 177.104 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.1 t -71.41 -17.95 62.37 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 120.93 0.395 . . . . 0.0 110.177 177.53 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -92.09 13.47 18.8 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.632 174.552 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 41.7 p90 46.61 22.75 0.19 Allowed 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.353 1.061 . . . . 0.0 112.87 178.258 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 24.4 m -107.98 18.28 21.42 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.102 0.477 . . . . 0.0 110.153 179.049 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.563 ' HB3' ' HG2' ' A' ' 33' ' ' LYS . 11.6 pt-20 -54.23 -19.88 5.99 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.824 -178.324 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -49.84 -48.02 51.27 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.906 176.951 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 10.1 m120 -57.42 -61.28 2.6 Favored 'General case' 0 C--O 1.244 0.799 0 CA-C-O 121.133 0.492 . . . . 0.0 111.878 -173.644 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.566 HG23 ' HG3' ' A' ' 42' ' ' GLU . 7.1 tp -56.3 -46.88 81.78 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.36 -177.467 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.566 ' HG3' HG23 ' A' ' 41' ' ' ILE . 46.9 mt-10 -78.6 -11.82 59.99 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.412 -176.333 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -70.74 -65.89 0.68 Allowed 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 116.561 -0.29 . . . . 0.0 110.32 177.705 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.487 ' HA ' ' SG ' ' A' ' 47' ' ' CYS . 22.8 p-90 -73.3 -19.51 61.02 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 119.6 -0.84 . . . . 0.0 111.484 -177.003 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 11.0 mt -60.56 -42.6 92.14 Favored 'Isoleucine or valine' 0 C--O 1.236 0.384 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 167.784 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.8 -28.73 62.75 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.914 178.873 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.509 ' O ' ' HB3' ' A' ' 50' ' ' PHE . 77.3 m -66.04 -37.06 84.9 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.798 179.233 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -77.93 -26.89 49.2 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.824 177.443 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.781 ' HA ' ' HE3' ' A' ' 52' ' ' LYS . 16.0 t70 -63.78 -39.37 94.08 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.577 0.703 . . . . 0.0 109.235 169.683 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.509 ' HB3' ' O ' ' A' ' 47' ' ' CYS . 91.4 t80 -61.51 -44.56 96.85 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.668 -1.151 . . . . 0.0 109.921 175.043 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.426 ' HA ' ' O ' ' A' ' 98' ' ' LEU . 23.7 ttpp -58.68 -39.22 80.07 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.831 -177.821 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.781 ' HE3' ' HA ' ' A' ' 49' ' ' ASP . 23.2 pttp -83.82 1.59 42.32 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 120.777 0.322 . . . . 0.0 111.647 -176.55 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 14.6 m -103.35 54.35 0.76 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.76 0.79 . . . . 0.0 108.934 175.265 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.93 -4.73 2.34 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.325 -1.307 . . . . 0.0 113.807 -167.511 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -61.24 116.27 9.1 Favored Glycine 0 C--O 1.224 -0.477 0 C-N-CA 120.533 -0.841 . . . . 0.0 111.25 177.554 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -44.72 -47.53 11.45 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 123.419 2.746 . . . . 0.0 113.133 -173.881 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' GLN . . . . . 0.459 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 50.8 mt-30 -63.37 -50.66 69.06 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 121.021 0.439 . . . . 0.0 109.844 178.686 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -55.97 -37.65 69.35 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.599 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.5 HG23 ' CZ ' ' A' ' 50' ' ' PHE . 23.9 mm -57.74 -53.02 50.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.714 178.035 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 7.3 m80 -63.38 -36.18 82.86 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.748 0.308 . . . . 0.0 110.682 -178.061 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.459 ' HG ' ' O ' ' A' ' 57' ' ' GLN . 88.5 mt -64.92 -50.56 66.0 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.931 -179.72 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -69.89 -36.47 75.45 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.872 -178.236 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.76 -48.24 82.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.674 179.553 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 20.3 tptp -68.38 -29.75 68.52 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.192 -179.266 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -65.81 -61.35 2.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.076 175.816 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 71.2 mt -55.2 -32.99 29.26 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.168 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.581 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.481 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 77.2 t80 -54.77 -66.16 0.45 Allowed 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.535 177.789 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.41 ' HG3' ' HD2' ' A' ' 67' ' ' TYR . 38.0 mt-10 -76.88 -12.34 59.95 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.911 -174.912 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 54.3 tptt -92.82 -32.84 14.49 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.247 -177.908 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' PHE . . . . . 0.425 ' HB3' ' CG2' ' A' ' 79' ' ' VAL . 80.5 m-85 -133.49 -49.32 0.84 Allowed 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -172.934 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.481 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 49.8 mm -67.53 -28.25 41.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 CA-C-O 121.096 0.475 . . . . 0.0 111.071 -171.486 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.542 ' HB3' ' HB2' ' A' ' 75' ' ' ALA . 0.0 OUTLIER -65.49 125.9 26.62 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.493 178.677 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 25.0 m -58.38 -30.03 66.48 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 121.27 0.557 . . . . 0.0 110.426 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 42.1 m-20 -109.42 94.02 4.82 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 170.675 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.542 ' HB2' ' HB3' ' A' ' 72' ' ' GLN . . . -152.37 164.89 18.84 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 115.439 -0.801 . . . . 0.0 109.832 -176.244 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.403 ' HD2' ' HB1' ' A' ' 75' ' ' ALA . 82.1 Cg_exo -46.77 -45.35 20.44 Favored 'Trans proline' 0 C--N 1.357 0.974 0 C-N-CA 122.643 2.228 . . . . 0.0 112.299 178.556 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -130.51 89.96 2.85 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 173.95 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.412 ' O ' ' HG2' ' A' ' 78' ' ' GLU . 0.6 OUTLIER -68.6 117.19 10.02 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.437 -179.12 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.425 ' CG2' ' HB3' ' A' ' 70' ' ' PHE . 97.3 t -69.31 138.81 21.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.615 178.895 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -79.45 30.72 0.23 Allowed 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.151 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.437 HD11 HG21 ' A' ' 85' ' ' THR . 39.4 tp -75.06 146.03 41.84 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.706 -175.844 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -53.04 145.94 12.12 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.26 -0.882 . . . . 0.0 112.052 178.569 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.417 ' HA ' ' HG2' ' A' ' 86' ' ' LYS . 39.9 p90 -66.71 -38.97 87.79 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.38 -176.336 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 79.8 t60 -69.42 -35.02 75.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.842 0.353 . . . . 0.0 110.361 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.437 HG21 HD11 ' A' ' 81' ' ' LEU . 21.4 m -70.34 -45.77 65.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.739 -179.56 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.487 ' O ' HG23 ' A' ' 90' ' ' THR . 19.3 ptpt -64.64 -31.12 72.2 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 178.961 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -58.73 -47.49 84.43 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.197 176.305 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 65.0 t -58.74 -43.08 87.04 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 CA-C-O 121.036 0.446 . . . . 0.0 110.284 177.724 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 65.0 mt -61.69 -46.9 95.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.17 -179.499 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.487 HG23 ' O ' ' A' ' 86' ' ' LYS . 78.8 p -60.26 -42.77 96.03 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.099 0.476 . . . . 0.0 110.864 -177.443 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -83.75 -7.01 59.57 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.96 -0.564 . . . . 0.0 112.143 -176.48 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 23.7 m -124.03 6.15 8.6 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 11.1 tp -67.25 -21.39 27.89 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 CA-C-O 120.999 0.428 . . . . 0.0 110.464 -178.031 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 9.9 t -58.73 -36.87 75.0 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.169 178.201 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -141.46 83.95 12.92 Favored Pre-proline 0 C--O 1.233 0.197 0 CA-C-O 120.953 0.406 . . . . 0.0 110.23 -179.379 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' PRO . . . . . 0.464 ' HG2' HG22 ' A' ' 59' ' ' ILE . 86.2 Cg_endo -81.55 156.56 18.87 Favored 'Trans proline' 0 CA--C 1.532 0.411 0 C-N-CA 122.714 2.276 . . . . 0.0 112.298 178.771 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.405 ' H ' ' HB2' ' A' ' 100' ' ' SER . 62.8 p -86.78 -171.82 3.71 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.575 176.594 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.426 ' O ' ' HA ' ' A' ' 51' ' ' LYS . 34.8 tp -51.04 -37.43 45.35 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.189 0.519 . . . . 0.0 110.847 -177.621 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -152.29 76.84 1.18 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.586 0.708 . . . . 0.0 109.537 170.803 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 100' ' ' SER . . . . . 0.405 ' HB2' ' H ' ' A' ' 97' ' ' THR . 13.1 t -58.83 -19.33 40.42 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 115.172 -0.922 . . . . 0.0 111.485 -176.346 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 75.9 m-85 -77.31 6.22 7.19 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.868 -179.567 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -52.16 -50.86 60.95 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 122.966 0.506 . . . . 0.0 111.034 177.631 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.422 ' O ' ' HD3' ' A' ' 107' ' ' ARG . . . -61.05 -42.58 98.75 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.535 179.253 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.19 -43.25 99.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.616 179.033 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 25.4 tt0 -54.53 -44.44 72.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.373 177.786 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' SER . . . . . 0.439 ' O ' ' HG2' ' A' ' 110' ' ' GLN . 32.1 m -56.96 -47.47 80.62 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.512 179.712 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 107' ' ' ARG . . . . . 0.458 ' O ' ' HG ' ' A' ' 111' ' ' LEU . 12.5 mpt_? -62.9 -63.93 1.06 Allowed 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.548 178.602 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.485 ' O ' ' HG3' ' A' ' 112' ' ' MET . 80.2 t -50.82 -42.45 23.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.435 -175.0 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 32.5 t80 -56.99 -59.53 4.92 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.119 179.159 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' GLN . . . . . 0.439 ' HG2' ' O ' ' A' ' 106' ' ' SER . 13.8 pt20 -71.26 -20.56 62.21 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 120.553 0.216 . . . . 0.0 111.455 -174.854 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' A' ' 107' ' ' ARG . 76.3 mt -69.65 -41.11 76.0 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.805 -0.18 . . . . 0.0 111.006 178.76 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 112' ' ' MET . . . . . 0.485 ' HG3' ' O ' ' A' ' 108' ' ' VAL . 0.0 OUTLIER -91.55 -12.02 35.63 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 120.955 -0.298 . . . . 0.0 110.79 178.932 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 113' ' ' GLU . . . . . 0.512 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 42.5 tt0 -68.05 -56.71 7.88 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 171.951 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -58.28 -22.88 54.35 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.226 -176.157 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -110.91 -69.28 0.88 Allowed 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 120.976 0.417 . . . . 0.0 111.089 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' SER . . . . . 0.48 ' HA ' ' HB3' ' A' ' 119' ' ' ARG . 22.1 m -69.58 -17.92 63.59 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 -168.805 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 117' ' ' TYR . . . . . 0.512 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 22.5 t80 -68.46 -60.44 2.43 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 118.116 0.417 . . . . 0.0 110.431 177.949 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 20.6 p -65.12 -34.47 78.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.314 0.578 . . . . 0.0 110.272 178.402 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' ARG . . . . . 0.48 ' HB3' ' HA ' ' A' ' 116' ' ' SER . 16.3 ttt180 -55.29 -46.8 76.2 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 114.953 -1.021 . . . . 0.0 109.472 173.313 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -65.62 -41.5 92.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.346 177.588 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.453 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 90.5 mt -58.21 -25.57 61.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.633 0.254 . . . . 0.0 111.21 -179.452 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 11.4 mptt -113.65 7.96 17.44 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 179.083 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 78.4 p -69.41 140.77 54.17 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 171.289 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -54.43 -33.49 59.58 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 111.522 0.193 . . . . 0.0 111.522 -179.354 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 9.9 tp -66.31 -40.81 87.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 CA-C-O 120.743 0.306 . . . . 0.0 110.878 -178.611 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 126' ' ' TYR . . . . . 0.535 ' O ' ' HG2' ' A' ' 130' ' ' MET . 84.7 t80 -72.17 -43.24 64.89 Favored 'General case' 0 C--O 1.232 0.176 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 176.349 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 91.4 mt -61.86 -23.79 66.5 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.199 177.351 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -68.58 -43.56 76.26 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.133 173.094 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 80.9 mt -61.65 -29.4 70.04 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.242 176.338 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 130' ' ' MET . . . . . 0.797 ' SD ' HG12 ' A' ' 9' ' ' VAL . 19.4 mmt . . . . . 0 C--O 1.235 0.315 0 CA-C-O 121.632 0.73 . . . . 0.0 110.498 -179.529 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.402 HG21 ' CH2' ' A' ' 11' ' ' TRP . 3.2 p . . . . . 0 C--O 1.233 0.224 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 17.6 m -62.13 136.24 95.28 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.109 179.493 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.467 ' HA ' ' HB3' ' A' ' 8' ' ' ALA . 8.2 Cg_endo -49.72 -26.77 13.81 Favored 'Trans proline' 0 C--N 1.355 0.872 0 C-N-CA 123.186 2.591 . . . . 0.0 112.464 -178.149 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.594 ' O ' HG22 ' A' ' 9' ' ' VAL . 32.8 tt0 -58.53 -58.06 10.2 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.16 176.168 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -59.25 -37.1 76.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.252 0.548 . . . . 0.0 110.187 175.798 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.467 ' HB3' ' HA ' ' A' ' 5' ' ' PRO . . . -62.5 -39.75 94.5 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.663 -177.642 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.594 HG22 ' O ' ' A' ' 6' ' ' GLU . 27.0 m -72.1 -26.58 25.3 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.297 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.261 178.011 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.587 ' HG2' ' O ' ' A' ' 6' ' ' GLU . 14.4 mmmm -63.31 -38.15 90.03 Favored 'General case' 0 N--CA 1.463 0.207 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 174.702 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.402 ' CH2' HG21 ' A' ' 3' ' ' VAL . 54.0 m0 -61.33 -29.65 70.02 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.634 176.168 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -74.42 6.96 20.49 Favored Glycine 0 CA--C 1.521 0.443 0 CA-C-N 115.64 -0.709 . . . . 0.0 113.719 -176.308 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.502 ' HG3' ' O ' ' A' ' 10' ' ' LYS . 0.0 OUTLIER -132.49 12.0 4.5 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 117.475 0.638 . . . . 0.0 111.244 176.391 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.418 ' HB3' ' HG2' ' A' ' 17' ' ' LYS . 44.2 t -171.0 100.59 0.21 Allowed 'General case' 0 C--O 1.237 0.444 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.169 176.863 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.429 ' HD1' HD23 ' A' ' 18' ' ' LEU . 37.0 t80 -55.12 -29.02 56.82 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.36 176.418 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -57.59 -52.06 66.94 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.994 -179.644 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.418 ' HG2' ' HB3' ' A' ' 14' ' ' SER . 17.7 ptpt -74.42 -28.39 61.05 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 120.946 -0.302 . . . . 0.0 110.533 -174.837 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.429 HD23 ' HD1' ' A' ' 15' ' ' PHE . 16.4 tp -57.19 -51.36 69.62 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.018 173.893 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.554 HD12 ' HA ' ' A' ' 25' ' ' LEU . 15.7 tp -82.9 -22.54 33.9 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.821 -175.508 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 23.2 t -76.71 -25.73 53.91 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.278 178.21 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -73.59 120.87 19.79 Favored 'General case' 0 C--O 1.222 -0.347 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 177.911 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.441 ' O ' ' HB3' ' A' ' 25' ' ' LEU . 60.9 mtp180 -43.06 -56.65 3.25 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.226 0.61 . . . . 0.0 112.551 -173.718 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -72.56 -26.52 61.76 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.816 0.341 . . . . 0.0 110.469 -178.381 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -68.17 -34.55 81.18 Favored Glycine 0 C--N 1.333 0.397 0 N-CA-C 111.384 -0.686 . . . . 0.0 111.384 176.325 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.554 ' HA ' HD12 ' A' ' 19' ' ' LEU . 9.3 tp -58.31 -54.72 43.83 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.536 0.684 . . . . 0.0 109.505 174.423 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.482 ' O ' ' HG2' ' A' ' 30' ' ' ARG . 8.8 tp10 -61.59 -34.58 75.86 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 114.715 -1.13 . . . . 0.0 110.459 -179.408 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.543 ' O ' ' HB2' ' A' ' 30' ' ' ARG . . . -68.28 -52.25 35.87 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 121.053 0.454 . . . . 0.0 111.153 179.323 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -64.75 -39.54 93.8 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.656 -177.711 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.539 ' OG1' ' HE2' ' A' ' 33' ' ' LYS . 3.6 t -64.31 -33.25 75.4 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 -179.482 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.543 ' HB2' ' O ' ' A' ' 27' ' ' ALA . 67.1 mmt-85 -52.43 -51.2 60.4 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.295 0.569 . . . . 0.0 109.556 171.927 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.464 ' O ' HG22 ' A' ' 34' ' ' THR . 69.2 t80 -64.56 -46.81 81.19 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 114.991 -1.004 . . . . 0.0 110.864 -178.158 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.567 ' HG ' ' H ' ' A' ' 38' ' ' GLU . 23.1 tp -70.48 -23.23 62.64 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.418 -175.583 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.539 ' HE2' ' OG1' ' A' ' 29' ' ' THR . 68.4 mttm -86.1 -34.15 20.73 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.771 -0.195 . . . . 0.0 110.964 178.53 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.464 HG22 ' O ' ' A' ' 31' ' ' PHE . 14.3 t -72.37 -22.94 61.07 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 121.08 -0.248 . . . . 0.0 110.854 -178.202 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.434 ' CD ' HH12 ' A' ' 119' ' ' ARG . 12.6 pt-20 -88.27 5.04 43.66 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 120.978 0.418 . . . . 0.0 110.028 174.088 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 33.0 t80 68.7 26.93 6.05 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.63 174.073 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 50.1 m -91.96 -78.52 0.4 Allowed 'General case' 0 CA--C 1.532 0.264 0 O-C-N 122.06 -0.4 . . . . 0.0 110.016 176.312 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.567 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 32.8 tt0 67.37 -64.61 0.25 Allowed 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 112.959 0.726 . . . . 0.0 112.959 175.667 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -39.32 -38.95 0.58 Allowed 'General case' 0 C--O 1.22 -0.484 0 C-N-CA 123.899 0.88 . . . . 0.0 113.061 -174.774 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.535 ' HB2' HD21 ' A' ' 32' ' ' LEU . 43.2 m-80 -50.43 -68.89 0.13 Allowed 'General case' 0 C--O 1.242 0.665 0 CA-C-O 121.062 0.458 . . . . 0.0 111.879 -176.668 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.493 HD12 HD11 ' A' ' 19' ' ' LEU . 3.7 tt -61.95 -44.33 98.76 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.857 -176.346 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -62.89 -31.59 72.68 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.081 -179.053 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 66.2 t80 -65.29 -66.71 0.51 Allowed 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.353 -177.209 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.498 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 33.6 p-90 -71.23 -23.97 62.1 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 119.707 -0.797 . . . . 0.0 111.805 -171.957 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 14.7 tt -66.85 -36.26 76.75 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 C-N-CA 120.213 -0.595 . . . . 0.0 109.592 177.1 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.0 -33.09 75.02 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 121.26 0.552 . . . . 0.0 109.887 173.647 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 72.5 m -70.4 -29.16 65.72 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.364 177.131 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.568 ' O ' ' HG3' ' A' ' 52' ' ' LYS . 37.0 mm-40 -72.93 -30.86 64.22 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 116.671 -0.24 . . . . 0.0 110.517 177.162 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.812 ' HA ' ' HE3' ' A' ' 52' ' ' LYS . 30.3 t70 -61.08 -42.18 98.03 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 172.126 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -63.46 -35.81 81.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.048 174.092 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.535 ' HB2' ' HA ' ' A' ' 48' ' ' GLU . 1.1 tppp? -59.28 -29.45 67.6 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.964 178.136 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.812 ' HE3' ' HA ' ' A' ' 49' ' ' ASP . 9.4 mtmp? -87.46 -19.6 27.77 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.104 -179.03 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 18.8 m -73.36 82.09 1.4 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.343 0.592 . . . . 0.0 111.102 -173.653 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.431 ' HD3' ' O ' ' A' ' 54' ' ' LYS . 0.0 OUTLIER -76.02 103.85 6.27 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.84 178.326 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 55' ' ' GLY . . . . . 0.524 ' O ' HG12 ' A' ' 59' ' ' ILE . . . 173.1 119.84 0.54 Allowed Glycine 0 N--CA 1.45 -0.406 0 N-CA-C 110.93 -0.868 . . . . 0.0 110.93 178.979 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_endo -55.35 -46.77 30.04 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.74 2.293 . . . . 0.0 112.348 -174.475 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' GLN . . . . . 0.407 ' OE1' ' N ' ' A' ' 57' ' ' GLN . 7.9 pm0 -67.75 -34.46 76.86 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.192 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -63.38 -40.76 98.11 Favored 'General case' 0 N--CA 1.462 0.14 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 179.149 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.525 HG22 ' HG2' ' A' ' 96' ' ' PRO . 47.3 mm -54.51 -42.03 57.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.907 -179.663 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 46.8 m80 -67.57 -56.1 10.78 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.194 -178.161 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.476 HD12 ' N ' ' A' ' 62' ' ' LYS . 3.9 pp -73.2 -34.46 65.98 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 112.534 0.568 . . . . 0.0 112.534 -171.191 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.476 ' N ' HD12 ' A' ' 61' ' ' LEU . 47.1 mtpt -75.95 -40.72 53.41 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 120.869 -0.333 . . . . 0.0 110.675 179.506 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.15 -41.71 97.07 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.879 0.371 . . . . 0.0 110.228 177.393 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 15.9 tppt? -60.39 -41.51 93.97 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.855 177.314 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.26 -49.4 77.22 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.934 179.159 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 68.8 mt -64.95 -35.76 76.16 Favored 'Isoleucine or valine' 0 C--O 1.234 0.273 0 CA-C-O 121.229 0.538 . . . . 0.0 110.35 178.477 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 74.0 t80 -57.88 -63.14 1.35 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.875 -179.078 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -68.96 -29.27 67.46 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.914 -173.578 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 64.9 tttm -94.93 -17.22 22.19 Favored 'General case' 0 C--O 1.237 0.423 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -172.704 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 99.2 m-85 -133.29 -52.16 0.89 Allowed 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 112.311 0.485 . . . . 0.0 112.311 -177.185 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 50.3 mm -67.03 -44.11 88.53 Favored 'Isoleucine or valine' 0 C--O 1.238 0.45 0 CA-C-O 120.886 0.374 . . . . 0.0 111.417 -172.048 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.465 ' HG3' ' H ' ' A' ' 74' ' ' ASP . 6.3 tp-100 -72.12 145.17 48.32 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.889 -174.624 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.422 ' O ' HG22 ' A' ' 73' ' ' THR . 13.2 m -85.78 27.45 0.86 Allowed 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 121.952 0.882 . . . . 0.0 110.36 178.944 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ASP . . . . . 0.465 ' H ' ' HG3' ' A' ' 72' ' ' GLN . 13.9 m-20 -128.83 20.96 5.94 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 174.018 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -86.33 159.38 53.49 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 114.988 -1.006 . . . . 0.0 111.837 -171.139 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_endo -85.65 11.63 3.29 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.964 2.443 . . . . 0.0 111.973 177.143 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.661 ' HA ' ' HE2' ' A' ' 77' ' ' LYS . 0.4 OUTLIER -128.57 -44.41 1.37 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.242 178.394 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 64.52 97.63 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.581 178.818 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 58.2 t -101.3 134.18 42.33 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.271 177.163 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 38.5 m-80 -83.48 27.32 0.61 Allowed 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.538 -176.182 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 9.4 tp -57.45 143.28 41.02 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.552 174.839 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -46.69 128.64 10.8 Favored 'General case' 0 C--O 1.237 0.446 0 O-C-N 123.892 0.745 . . . . 0.0 111.7 -175.919 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -59.22 -45.75 90.28 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.196 -175.046 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' HIS . . . . . 0.478 ' O ' ' HB3' ' A' ' 87' ' ' GLU . 54.0 t60 -61.15 -29.63 69.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.898 179.662 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 28.2 m -71.34 -49.41 42.74 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.746 179.075 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.528 ' O ' HG23 ' A' ' 90' ' ' THR . 17.8 ptpt -66.95 -23.22 65.93 Favored 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 120.816 -0.353 . . . . 0.0 110.081 179.769 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.478 ' HB3' ' O ' ' A' ' 84' ' ' HIS . 41.1 tt0 -58.29 -53.09 62.19 Favored 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 171.196 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 58.5 t -58.88 -41.22 82.28 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.335 176.556 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 69.3 mt -60.41 -43.94 95.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.233 -179.515 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.528 HG23 ' O ' ' A' ' 86' ' ' LYS . 76.4 p -61.9 -31.68 72.0 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.214 0.53 . . . . 0.0 110.147 178.904 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -79.95 -16.94 54.23 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.209 179.165 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 20.3 m -108.79 -14.24 14.63 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -176.841 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.0 tp -64.49 -21.61 29.51 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -170.959 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 7.7 t -57.01 -44.99 83.34 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 120.999 0.428 . . . . 0.0 110.368 177.705 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 -149.64 80.77 7.41 Favored Pre-proline 0 C--O 1.238 0.47 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 178.367 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' PRO . . . . . 0.525 ' HG2' HG22 ' A' ' 59' ' ' ILE . 74.1 Cg_endo -75.42 -161.67 0.13 Allowed 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 123.058 2.505 . . . . 0.0 112.591 -176.368 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 9.4 m -152.49 165.73 34.18 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.671 -176.198 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -47.32 -60.72 2.31 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 122.644 0.378 . . . . 0.0 111.489 -177.839 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' HIS . . . . . 0.464 ' ND1' ' HD2' ' A' ' 51' ' ' LYS . 77.0 m-70 -95.32 24.54 4.98 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.548 -0.297 . . . . 0.0 111.51 -177.085 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 41.4 t -66.24 -40.15 90.05 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.268 0.556 . . . . 0.0 109.724 176.356 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 81.7 m-85 -88.02 6.91 33.75 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.911 179.1 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' ASP . . . . . 0.511 ' O ' ' HB3' ' A' ' 105' ' ' GLN . 9.5 t70 -70.54 -33.88 71.64 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 178.255 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.581 ' O ' ' HG2' ' A' ' 107' ' ' ARG . . . -61.99 -42.51 99.23 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.629 173.561 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.05 -41.03 86.9 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.064 176.927 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.511 ' HB3' ' O ' ' A' ' 102' ' ' ASP . 15.2 tt0 -53.24 -53.94 43.43 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.954 174.232 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 42.7 t -51.72 -44.98 63.41 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.253 -177.828 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' ARG . . . . . 0.581 ' HG2' ' O ' ' A' ' 103' ' ' ALA . 19.9 mmm180 -62.8 -50.72 69.88 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 120.937 0.398 . . . . 0.0 111.076 -175.49 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 90.7 t -71.52 -42.76 72.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.925 -177.776 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 59.8 t80 -58.12 -53.21 60.8 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.525 179.606 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' GLN . . . . . 0.534 ' O ' ' HG2' ' A' ' 114' ' ' GLN . 0.0 OUTLIER -64.98 -32.05 73.59 Favored 'General case' 0 N--CA 1.461 0.091 0 N-CA-C 110.159 -0.312 . . . . 0.0 110.159 -178.994 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 58.2 tp -62.14 -62.32 1.86 Allowed 'General case' 0 N--CA 1.46 0.053 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.549 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' MET . . . . . 0.471 ' O ' ' HB3' ' A' ' 116' ' ' SER . 25.4 ptt? -67.72 -21.55 65.29 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-O 120.747 0.308 . . . . 0.0 110.43 -178.443 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 113' ' ' GLU . . . . . 0.528 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 42.6 tt0 -64.22 -55.55 20.79 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 174.723 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 114' ' ' GLN . . . . . 0.534 ' HG2' ' O ' ' A' ' 110' ' ' GLN . 12.6 pt20 -77.5 -18.43 57.08 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.774 -177.046 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -114.96 3.9 14.64 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 -175.798 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' SER . . . . . 0.471 ' HB3' ' O ' ' A' ' 112' ' ' MET . 32.2 t -147.03 -43.53 0.18 Allowed 'General case' 0 N--CA 1.466 0.339 0 O-C-N 122.068 -0.395 . . . . 0.0 111.442 177.726 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 117' ' ' TYR . . . . . 0.528 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 32.4 t80 -65.93 -40.3 91.29 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 120.913 0.387 . . . . 0.0 110.579 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 29.9 p -56.73 -55.01 39.67 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-O 121.665 0.745 . . . . 0.0 110.035 174.774 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' ARG . . . . . 0.434 HH12 ' CD ' ' A' ' 35' ' ' GLU . 27.1 mtp180 -58.2 -35.34 71.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 114.881 -1.054 . . . . 0.0 110.863 176.558 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 79.4 t80 -60.71 -45.3 94.77 Favored 'General case' 0 C--O 1.224 -0.282 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 179.618 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 87.4 mt -63.67 -23.58 67.43 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.954 0.407 . . . . 0.0 110.471 177.995 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -101.43 0.77 37.44 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.17 -0.468 . . . . 0.0 112.255 179.054 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 76.6 p -76.58 147.08 37.89 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 120.627 0.251 . . . . 0.0 110.513 -176.75 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -58.21 -31.17 67.08 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 175.685 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 43.7 mm -56.69 -48.94 79.99 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 CA-C-N 115.144 -0.935 . . . . 0.0 110.631 175.615 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 126' ' ' TYR . . . . . 0.424 ' O ' ' HG2' ' A' ' 130' ' ' MET . 88.4 t80 -66.43 -43.66 85.04 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.572 -179.252 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -62.14 -34.12 75.76 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.408 178.114 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -64.36 -35.24 80.25 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.061 175.023 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 99.6 mt -76.53 -25.69 54.41 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.84 177.328 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 130' ' ' MET . . . . . 0.424 ' HG2' ' O ' ' A' ' 126' ' ' TYR . 12.7 mmt . . . . . 0 N--CA 1.464 0.269 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.338 178.254 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.516 HG21 ' CZ2' ' A' ' 11' ' ' TRP . 8.9 p . . . . . 0 CA--C 1.534 0.328 0 CA-C-O 120.926 0.393 . . . . 0.0 111.264 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.4 m -91.9 148.81 37.79 Favored Pre-proline 0 CA--C 1.534 0.362 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.059 177.067 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -50.38 -36.49 48.19 Favored 'Trans proline' 0 C--N 1.353 0.768 0 C-N-CA 123.078 2.518 . . . . 0.0 113.007 -176.749 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.566 ' O ' HG22 ' A' ' 9' ' ' VAL . 1.0 OUTLIER -65.65 -41.07 92.99 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 121.473 0.654 . . . . 0.0 110.029 179.844 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.521 ' O ' ' HB2' ' A' ' 10' ' ' LYS . 2.6 tm-20 -69.64 -30.27 67.93 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 178.283 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.83 -44.54 80.86 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.067 178.431 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.669 HG12 ' SD ' ' A' ' 130' ' ' MET . 17.5 m -66.3 -26.07 37.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 CA-C-O 120.942 0.401 . . . . 0.0 110.39 179.495 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.53 ' O ' ' HG2' ' A' ' 13' ' ' GLU . 41.5 mmtm -57.89 -34.56 69.93 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.984 175.038 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.516 ' CZ2' HG21 ' A' ' 3' ' ' VAL . 43.1 m0 -60.08 -32.43 70.95 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 120.871 0.367 . . . . 0.0 110.946 -179.142 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -65.19 -3.15 10.88 Favored Glycine 0 CA--C 1.521 0.448 0 CA-C-N 115.667 -0.697 . . . . 0.0 114.477 -171.907 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.53 ' HG2' ' O ' ' A' ' 10' ' ' LYS . 13.4 pt-20 -91.35 -32.52 15.65 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 117.68 0.74 . . . . 0.0 110.897 179.406 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 51.8 m -150.37 123.58 8.89 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.022 -174.92 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.479 ' HZ ' ' SD ' ' A' ' 112' ' ' MET . 17.9 t80 -58.92 -32.48 69.6 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.984 176.55 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -54.46 -43.73 71.94 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.904 175.253 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -67.59 -42.58 82.26 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.343 179.103 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 68.2 tp -54.44 -38.98 66.93 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.17 177.199 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 53.1 tp -75.11 -28.4 60.21 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.027 179.407 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 38.4 m -68.23 -36.18 79.1 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.258 -177.396 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -86.77 121.5 29.36 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 179.748 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.6 ptm180 -58.08 -28.21 64.36 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.118 0.485 . . . . 0.0 110.292 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -61.75 -49.6 75.76 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.36 174.402 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -63.68 -44.67 96.04 Favored Glycine 0 C--N 1.335 0.492 0 CA-C-N 115.018 -0.992 . . . . 0.0 111.778 179.447 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 15.3 tp -48.7 -60.39 2.76 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 123.018 0.527 . . . . 0.0 111.072 177.314 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.478 ' O ' ' HB2' ' A' ' 30' ' ' ARG . 11.1 tp10 -59.01 -50.01 75.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.874 -175.975 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -60.68 -35.13 75.51 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 121.053 0.454 . . . . 0.0 111.106 -179.084 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 91.9 t80 -75.08 -46.3 35.59 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.861 -176.58 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.58 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 11.9 t -70.75 -27.8 64.22 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 -176.164 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.478 ' HB2' ' O ' ' A' ' 26' ' ' GLU . 0.2 OUTLIER -61.83 -54.73 38.14 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.191 -0.913 . . . . 0.0 109.863 177.714 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.49 ' O ' ' HB ' ' A' ' 34' ' ' THR . 86.9 t80 -57.62 -34.06 68.9 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.178 0.513 . . . . 0.0 110.653 -179.087 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 26.7 tp -74.81 -45.99 39.81 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.947 -178.242 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.58 ' HG3' ' O ' ' A' ' 29' ' ' THR . 68.3 mttm -60.95 -25.4 66.79 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.232 0.539 . . . . 0.0 110.002 177.211 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.49 ' HB ' ' O ' ' A' ' 31' ' ' PHE . 96.4 m -60.77 -35.31 76.09 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.263 177.691 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -101.89 9.78 40.34 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 120.986 0.422 . . . . 0.0 110.481 176.709 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 83.6 m-85 66.23 8.26 5.45 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.478 -0.783 . . . . 0.0 112.572 173.926 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 21.4 t -92.81 43.33 1.12 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.191 0.52 . . . . 0.0 109.751 -178.977 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -86.4 2.03 49.11 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.746 -174.711 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.35 -31.57 72.83 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -175.935 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.47 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 6.2 p30 -69.25 -57.99 4.63 Favored 'General case' 0 C--O 1.246 0.88 0 N-CA-C 111.969 0.359 . . . . 0.0 111.969 -176.38 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.517 ' HA ' ' HE1' ' A' ' 112' ' ' MET . 13.8 tt -63.0 -46.81 95.36 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-O 120.574 0.226 . . . . 0.0 110.477 -177.184 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -62.99 -24.5 67.94 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.066 177.681 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.47 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 82.9 t80 -62.75 -63.2 1.28 Allowed 'General case' 0 C--O 1.235 0.312 0 C-N-CA 121.399 -0.121 . . . . 0.0 111.022 179.552 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.605 ' HE1' ' HE3' ' A' ' 112' ' ' MET . 20.9 p-90 -70.97 -19.86 62.5 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 119.439 -0.904 . . . . 0.0 111.468 -175.146 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.419 HG13 ' O ' ' A' ' 41' ' ' ILE . 66.3 mt -67.33 -51.05 56.84 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 CA-C-O 121.293 0.568 . . . . 0.0 109.786 170.846 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.39 -28.6 69.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.514 178.693 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.625 ' SG ' ' HB2' ' A' ' 101' ' ' PHE . 41.0 t -68.58 -33.43 74.05 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.583 -179.722 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.731 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 10.5 pt-20 -83.29 -25.69 31.33 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 120.444 -0.503 . . . . 0.0 110.318 176.661 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.465 ' HA ' ' HE3' ' A' ' 52' ' ' LYS . 18.1 t70 -62.57 -33.37 74.82 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 168.81 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -71.62 -56.12 6.45 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 114.632 -1.167 . . . . 0.0 111.121 174.599 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.731 ' HG2' ' HA ' ' A' ' 48' ' ' GLU . 25.4 pttm -85.03 11.49 9.47 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -171.4 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.465 ' HE3' ' HA ' ' A' ' 49' ' ' ASP . 18.5 ptpt -88.67 -24.19 22.82 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 168.832 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.4 ' HB2' ' HG2' ' A' ' 58' ' ' GLN . 17.3 p -90.25 122.03 32.81 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 174.89 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -100.13 6.16 44.89 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.623 -172.259 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' GLY . . . . . 0.448 ' O ' HG12 ' A' ' 59' ' ' ILE . . . -67.09 123.03 20.59 Favored Glycine 0 CA--C 1.519 0.309 0 C-N-CA 121.015 -0.612 . . . . 0.0 112.013 179.187 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.401 ' HD2' ' HA2' ' A' ' 55' ' ' GLY . 12.2 Cg_endo -54.05 -46.91 30.12 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.671 2.248 . . . . 0.0 112.067 -177.922 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 82.0 mm-40 -64.29 -40.52 96.13 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 121.346 0.593 . . . . 0.0 109.845 178.545 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.462 ' OE1' HD11 ' A' ' 61' ' ' LEU . 6.5 tp-100 -58.66 -43.29 89.82 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 114.829 -1.078 . . . . 0.0 110.557 -179.116 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.448 HG12 ' O ' ' A' ' 55' ' ' GLY . 42.3 mm -57.29 -49.5 79.75 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.212 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.809 -178.055 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 77.4 m80 -64.45 -54.3 34.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.596 -0.275 . . . . 0.0 111.563 -173.933 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.516 HD12 ' N ' ' A' ' 62' ' ' LYS . 4.2 pp -64.48 -31.83 73.21 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.624 0.249 . . . . 0.0 111.648 -175.88 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.516 ' N ' HD12 ' A' ' 61' ' ' LEU . 36.3 mmtm -71.49 -53.16 14.82 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 120.629 0.252 . . . . 0.0 110.544 176.414 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.69 -38.08 74.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.885 -178.626 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 27.6 tptp -65.49 -41.26 93.46 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.232 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -64.84 -50.81 65.21 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.687 178.463 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 70.6 mt -58.58 -36.56 60.26 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.206 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.198 178.42 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.473 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 91.6 t80 -56.01 -63.65 1.11 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.674 178.327 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -64.4 -35.34 80.6 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.752 -0.658 . . . . 0.0 112.04 -174.794 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 80.9 tttt -90.32 -25.84 20.29 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -170.195 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -127.15 -48.36 1.46 Allowed 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -174.272 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.473 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 48.4 mm -70.56 -38.37 73.24 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 CA-C-O 120.947 0.403 . . . . 0.0 111.19 -173.396 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.503 ' HB3' ' HB2' ' A' ' 75' ' ' ALA . 6.2 tp-100 -61.04 141.37 57.44 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.106 -176.402 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 28.8 m -73.59 -35.06 65.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.237 0.541 . . . . 0.0 110.73 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -93.68 27.66 2.6 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.206 0.527 . . . . 0.0 110.501 175.098 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.503 ' HB2' ' HB3' ' A' ' 72' ' ' GLN . . . -70.93 160.64 81.67 Favored Pre-proline 0 C--O 1.235 0.341 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.49 176.489 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.481 ' HD2' ' HB1' ' A' ' 75' ' ' ALA . 12.2 Cg_endo -55.1 -35.03 89.58 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.799 2.332 . . . . 0.0 112.268 -179.097 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.427 ' O ' ' HB3' ' A' ' 78' ' ' GLU . 33.6 mtmm -122.95 -50.27 1.94 Allowed 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.826 176.895 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.427 ' HB3' ' O ' ' A' ' 77' ' ' LYS . 44.0 tt0 68.9 139.81 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.375 0 O-C-N 123.698 0.623 . . . . 0.0 110.803 -175.132 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.415 ' C ' ' H ' ' A' ' 81' ' ' LEU . 60.8 t -95.44 149.15 4.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.427 175.495 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 41.8 m-80 -70.68 17.24 0.07 Allowed 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 -177.642 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.575 HD11 HG21 ' A' ' 85' ' ' THR . 47.4 tp -60.97 144.07 53.96 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 122.746 0.418 . . . . 0.0 110.822 176.647 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -54.92 143.38 26.33 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.744 -177.054 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.448 ' HA ' ' HG2' ' A' ' 86' ' ' LYS . 89.9 t80 -62.23 -44.7 95.96 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.872 -178.673 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' HIS . . . . . 0.416 ' O ' HG23 ' A' ' 88' ' ' VAL . 82.0 t60 -66.87 -30.31 70.44 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.567 0.222 . . . . 0.0 110.749 -178.915 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.575 HG21 HD11 ' A' ' 81' ' ' LEU . 27.1 m -69.29 -48.18 62.37 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 177.84 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.513 ' O ' HG23 ' A' ' 90' ' ' THR . 19.0 ptpt -65.97 -28.36 68.84 Favored 'General case' 0 N--CA 1.462 0.129 0 N-CA-C 109.754 -0.462 . . . . 0.0 109.754 178.011 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -60.18 -49.31 78.12 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.148 177.704 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.416 HG23 ' O ' ' A' ' 84' ' ' HIS . 58.3 t -56.4 -40.82 69.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 121.253 0.549 . . . . 0.0 109.678 176.209 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 72.3 mt -63.9 -42.62 96.41 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.968 178.753 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.513 HG23 ' O ' ' A' ' 86' ' ' LYS . 67.9 p -62.61 -25.35 68.05 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.891 0.377 . . . . 0.0 110.9 -178.126 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 57.4 m-80 -90.59 -23.74 20.76 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.252 178.615 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 31.1 t -98.22 -9.64 25.31 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.63 -176.716 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 9.4 tp -60.89 -26.14 37.81 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 N-CA-C 112.003 0.371 . . . . 0.0 112.003 -174.687 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 12.3 t -68.57 -24.41 64.6 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 120.83 0.348 . . . . 0.0 110.791 -179.191 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -144.68 76.05 14.34 Favored Pre-proline 0 CA--C 1.532 0.268 0 CA-C-N 116.213 -0.448 . . . . 0.0 109.907 179.466 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -82.3 153.22 16.12 Favored 'Trans proline' 0 C--O 1.237 0.45 0 C-N-CA 122.671 2.247 . . . . 0.0 112.484 -178.118 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 47.8 p -111.3 174.09 6.03 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.228 176.871 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 34.7 tp -57.78 -57.27 13.49 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.371 0.605 . . . . 0.0 111.111 -178.297 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' HIS . . . . . 0.42 ' ND1' ' HB3' ' A' ' 102' ' ' ASP . 1.2 t-80 -95.85 12.65 29.42 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.326 -171.861 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 22.7 p -44.26 -47.42 9.4 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -172.312 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.625 ' HB2' ' SG ' ' A' ' 47' ' ' CYS . 99.0 m-85 -78.85 11.61 2.56 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.244 0.831 . . . . 0.0 113.244 -171.892 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' ASP . . . . . 0.455 ' HA ' ' HG2' ' A' ' 105' ' ' GLN . 8.6 p30 -60.47 -38.68 85.03 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 118.189 0.45 . . . . 0.0 111.545 -177.887 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.07 -38.76 83.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.191 0.519 . . . . 0.0 110.372 176.021 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.8 -36.16 79.92 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.801 -179.655 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.49 ' HG2' ' O ' ' A' ' 101' ' ' PHE . 13.0 mm-40 -56.87 -49.17 76.31 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.308 0.575 . . . . 0.0 109.569 179.822 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 45.2 t -59.12 -49.11 79.14 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.04 -0.982 . . . . 0.0 110.923 -179.024 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 28.1 mmm180 -59.46 -47.33 85.9 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.242 -177.491 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.432 HG21 ' CD2' ' A' ' 43' ' ' PHE . 88.6 t -66.61 -41.54 88.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.156 -178.623 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 65.1 t80 -64.86 -43.43 93.0 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.361 -177.695 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 5.3 pp0? -69.58 -37.25 76.87 Favored 'General case' 0 C--O 1.239 0.512 0 N-CA-C 111.535 0.198 . . . . 0.0 111.535 -175.863 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 4.5 pp -73.58 -24.84 60.13 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-O 120.836 0.35 . . . . 0.0 110.2 179.23 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' MET . . . . . 0.605 ' HE3' ' HE1' ' A' ' 44' ' ' TRP . 34.4 ttm -66.38 -50.17 64.39 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.771 -0.65 . . . . 0.0 109.997 175.136 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 113' ' ' GLU . . . . . 0.573 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 38.2 tt0 -54.88 -57.86 9.91 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.081 -178.127 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -60.88 -9.38 4.08 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 112.963 0.727 . . . . 0.0 112.963 -172.028 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' ASP . . . . . 0.456 ' O ' ' HG3' ' A' ' 119' ' ' ARG . 32.9 t70 -126.93 -68.85 0.78 Allowed 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 120.61 0.243 . . . . 0.0 111.087 178.973 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 22.7 t -60.96 -38.38 85.69 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 111.697 0.258 . . . . 0.0 111.697 -175.768 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' TYR . . . . . 0.573 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 42.0 t80 -71.52 -40.78 69.88 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 120.722 0.296 . . . . 0.0 110.706 -177.261 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 34.5 p -65.93 -43.73 87.23 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 109.905 -0.405 . . . . 0.0 109.905 177.851 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' ARG . . . . . 0.456 ' HG3' ' O ' ' A' ' 115' ' ' ASP . 90.2 mtt180 -55.66 -44.1 76.91 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.135 174.213 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -58.95 -41.98 88.76 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.299 179.188 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 83.6 mt -70.88 -14.86 62.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.811 0.338 . . . . 0.0 111.113 179.134 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 122' ' ' LYS . . . . . 0.623 ' HE3' ' HA ' ' A' ' 122' ' ' LYS . 0.0 OUTLIER -113.88 7.48 17.0 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.601 179.326 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 97.0 p -84.42 148.95 26.31 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 120.624 0.25 . . . . 0.0 111.041 -179.412 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -60.15 -29.92 68.97 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 174.702 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 42.0 mm -55.12 -57.09 8.06 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-N 115.261 -0.881 . . . . 0.0 111.167 178.646 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 126' ' ' TYR . . . . . 0.463 ' O ' ' HG2' ' A' ' 130' ' ' MET . 31.7 t80 -66.22 -38.75 88.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.909 0.385 . . . . 0.0 110.324 -178.236 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 92.1 mt -65.27 -28.57 69.43 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.599 178.512 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -71.9 -37.56 70.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.001 178.194 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 81.0 mt -64.6 -31.84 73.23 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.964 176.352 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 130' ' ' MET . . . . . 0.669 ' SD ' HG12 ' A' ' 9' ' ' VAL . 26.2 mmt . . . . . 0 C--O 1.232 0.181 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.769 176.846 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.475 HG12 HD22 ' A' ' 129' ' ' LEU . 14.7 p . . . . . 0 C--O 1.235 0.313 0 CA-C-O 121.091 0.472 . . . . 0.0 111.901 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 29.5 m -95.58 149.24 35.82 Favored Pre-proline 0 CA--C 1.535 0.372 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.434 173.155 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -44.21 -46.39 11.47 Favored 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 123.623 2.882 . . . . 0.0 113.793 -173.056 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.641 ' O ' HG22 ' A' ' 9' ' ' VAL . 33.9 tt0 -61.78 -47.7 83.96 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 120.696 0.284 . . . . 0.0 111.178 -175.8 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -64.35 -34.96 79.35 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.109 0.48 . . . . 0.0 109.889 178.235 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.61 -38.29 89.64 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.235 -179.605 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.641 HG22 ' O ' ' A' ' 6' ' ' GLU . 11.4 m -75.15 -25.89 18.55 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 C-N-CA 120.92 -0.312 . . . . 0.0 110.63 179.833 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.554 ' HG2' ' O ' ' A' ' 6' ' ' GLU . 74.8 mmtt -60.35 -34.48 73.9 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.008 0.432 . . . . 0.0 110.268 176.86 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.416 ' CE3' HD13 ' A' ' 18' ' ' LEU . 49.1 m0 -61.72 -22.37 65.31 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.802 179.451 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -64.61 -13.03 54.73 Favored Glycine 0 CA--C 1.519 0.31 0 CA-C-N 115.848 -0.614 . . . . 0.0 113.072 -178.098 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.527 ' HG2' ' O ' ' A' ' 10' ' ' LYS . 10.7 pt-20 -79.89 -23.19 42.01 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 117.029 0.415 . . . . 0.0 110.739 179.78 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 31.6 t -171.0 132.01 0.83 Allowed 'General case' 0 C--O 1.238 0.469 0 CA-C-O 121.377 0.608 . . . . 0.0 111.716 -177.261 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 28.6 t80 -60.86 -29.04 69.29 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.861 174.385 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -55.85 -43.79 77.39 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.508 175.555 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 33.3 ttmt -66.96 -40.49 87.5 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.479 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.416 HD13 ' CE3' ' A' ' 11' ' ' TRP . 39.1 tp -59.23 -40.5 86.1 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.149 0.499 . . . . 0.0 110.311 175.514 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 39.6 tp -73.86 -36.67 64.86 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.341 -176.429 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 24.6 p -79.56 -23.26 42.92 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.583 -177.017 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.71 114.45 13.15 Favored 'General case' 0 C--O 1.223 -0.304 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 177.193 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.514 ' HD2' ' H ' ' A' ' 22' ' ' ARG . 4.2 mpt_? -56.18 -42.32 76.89 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 120.902 0.382 . . . . 0.0 111.167 -170.709 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -70.18 -33.05 71.27 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.693 176.365 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -64.72 -54.19 30.13 Favored Glycine 0 C--N 1.332 0.357 0 N-CA-C 111.397 -0.681 . . . . 0.0 111.397 177.716 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.9 tt -54.63 -40.0 68.53 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 123.085 0.554 . . . . 0.0 110.308 174.736 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -60.87 -42.83 98.68 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-O 121.059 0.456 . . . . 0.0 110.305 177.73 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -68.87 -36.88 78.62 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.202 0.525 . . . . 0.0 110.516 178.158 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 77.3 t80 -70.32 -43.22 70.75 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.712 -175.46 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.584 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 7.2 t -64.85 -44.04 91.05 Favored 'General case' 0 C--N 1.333 -0.137 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 178.658 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 87.7 mtm180 -57.85 -27.76 63.51 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-O 121.047 0.451 . . . . 0.0 110.651 178.816 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.522 ' O ' HG22 ' A' ' 34' ' ' THR . 75.9 t80 -83.32 -41.17 18.55 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.779 175.036 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 17.5 tp -76.62 -21.26 55.77 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.744 -171.483 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.584 ' HG3' ' O ' ' A' ' 29' ' ' THR . 68.5 mttm -61.68 -30.51 70.78 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.343 -178.855 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.522 HG22 ' O ' ' A' ' 31' ' ' PHE . 9.6 t -65.37 -31.0 71.89 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.077 -175.601 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -102.3 8.05 40.46 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 120.916 0.388 . . . . 0.0 110.79 179.41 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 88.9 m-85 59.79 20.05 8.87 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.897 174.435 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 33.0 t -85.59 1.06 50.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.197 0.522 . . . . 0.0 110.348 -177.429 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 52.1 tt0 -58.91 -30.85 68.12 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.283 -179.595 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -60.74 -24.16 65.49 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.136 179.772 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.522 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 93.6 m-20 -68.21 -39.96 82.25 Favored 'General case' 0 C--O 1.238 0.459 0 CA-C-O 121.405 0.621 . . . . 0.0 109.424 174.689 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.4 ' O ' HG13 ' A' ' 45' ' ' ILE . 46.0 mt -63.47 -49.73 81.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.422 173.88 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.444 ' HA ' ' HB ' ' A' ' 45' ' ' ILE . 49.9 mt-10 -60.85 -27.21 67.93 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.891 178.273 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.522 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 62.5 t80 -58.67 -62.61 1.73 Allowed 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.302 176.694 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.526 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 16.0 p-90 -74.91 -14.61 60.67 Favored 'General case' 0 CA--C 1.528 0.1 0 C-N-CA 119.66 -0.816 . . . . 0.0 111.442 -177.933 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.444 ' HB ' ' HA ' ' A' ' 42' ' ' GLU . 15.6 mt -61.9 -47.11 94.74 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 167.797 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.83 -30.15 70.27 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.275 177.074 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.419 ' HB3' ' HA ' ' A' ' 44' ' ' TRP . 25.6 t -62.71 -46.28 88.84 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.455 175.897 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.526 ' HG2' ' O ' ' A' ' 44' ' ' TRP . 26.7 mm-40 -64.35 -35.09 79.75 Favored 'General case' 0 C--N 1.333 -0.134 0 N-CA-C 110.133 -0.321 . . . . 0.0 110.133 178.534 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.421 ' HA ' ' HE2' ' A' ' 52' ' ' LYS . 1.3 m-20 -57.61 -47.54 81.88 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 173.234 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.418 ' CZ ' HG23 ' A' ' 59' ' ' ILE . 57.8 t80 -59.73 -39.05 83.43 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.457 177.04 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.441 ' HE3' ' ND1' ' A' ' 99' ' ' HIS . 53.3 mtpt -72.82 -26.61 61.56 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.807 -177.819 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.459 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 65.1 pttt -105.04 -1.89 25.09 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 111.614 0.227 . . . . 0.0 111.614 -178.329 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 35.6 p -79.37 135.48 36.72 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 110.308 -0.256 . . . . 0.0 110.308 177.531 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.68 154.75 20.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.975 0.417 . . . . 0.0 110.499 -179.828 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 99.58 110.83 3.17 Favored Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 111.115 -0.794 . . . . 0.0 111.115 -176.31 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -51.55 -38.88 65.58 Favored 'Trans proline' 0 C--N 1.352 0.736 0 C-N-CA 122.9 2.4 . . . . 0.0 111.851 -177.293 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 -54.54 -49.89 69.23 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.119 178.95 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 8.5 tp-100 -58.16 -43.49 87.43 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.15 -0.932 . . . . 0.0 110.016 -179.502 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.418 HG23 ' CZ ' ' A' ' 50' ' ' PHE . 46.7 mm -60.88 -46.82 95.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.505 -178.79 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.447 ' O ' ' HG2' ' A' ' 64' ' ' LYS . 1.5 m80 -62.7 -48.14 80.57 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.358 -174.972 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.587 HD12 ' N ' ' A' ' 62' ' ' LYS . 3.6 pp -72.48 -38.05 68.28 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.47 -176.644 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.587 ' N ' HD12 ' A' ' 61' ' ' LEU . 28.7 mmtp -64.76 -38.68 91.79 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.786 0.327 . . . . 0.0 110.566 177.943 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.04 -47.61 77.55 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.499 177.014 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.447 ' HG2' ' O ' ' A' ' 60' ' ' HIS . 48.3 mmtm -62.62 -40.79 98.06 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.898 -179.429 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.83 -55.61 28.06 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.355 -178.404 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 68.0 mt -60.99 -35.99 69.09 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 CA-C-O 121.296 0.57 . . . . 0.0 110.244 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.528 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 79.7 t80 -59.2 -67.99 0.32 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.152 -179.432 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -61.51 -31.52 71.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.254 -0.43 . . . . 0.0 112.013 -173.558 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.42 ' HE3' ' CE2' ' A' ' 70' ' ' PHE . 36.4 ttpt -83.03 -32.26 26.98 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.225 0.454 . . . . 0.0 112.225 -172.699 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' PHE . . . . . 0.42 ' CE2' ' HE3' ' A' ' 69' ' ' LYS . 51.2 m-85 -131.98 -46.87 0.94 Allowed 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 112.894 0.702 . . . . 0.0 112.894 -174.922 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.528 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 47.7 mm -68.95 -37.14 76.9 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 CA-C-O 120.749 0.309 . . . . 0.0 111.581 -173.215 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.761 ' HG3' ' H ' ' A' ' 74' ' ' ASP . 6.4 tp-100 -57.98 138.29 56.03 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.868 -176.513 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 15.3 m -79.92 9.3 5.5 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.747 0.784 . . . . 0.0 110.708 -179.202 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ASP . . . . . 0.761 ' H ' ' HG3' ' A' ' 72' ' ' GLN . 22.0 m-20 -132.9 25.23 4.3 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.245 -0.888 . . . . 0.0 108.744 172.204 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.78 156.02 92.57 Favored Pre-proline 0 CA--C 1.531 0.225 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.031 -178.2 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -62.17 -23.93 75.87 Favored 'Trans proline' 0 C--N 1.35 0.619 0 C-N-CA 122.702 2.268 . . . . 0.0 112.762 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 30.9 mmtp -115.57 -56.84 2.3 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.312 179.167 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 65.8 114.77 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.372 0 O-C-N 123.671 0.607 . . . . 0.0 110.983 -173.973 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.441 ' O ' HG12 ' A' ' 79' ' ' VAL . 10.6 t -91.88 25.6 0.39 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 CA-C-O 121.118 0.485 . . . . 0.0 110.101 179.187 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 9.5 p30 43.01 27.97 0.12 Allowed 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.821 0.848 . . . . 0.0 112.388 179.277 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.481 HD11 HG21 ' A' ' 85' ' ' THR . 24.5 tp -56.79 145.45 29.3 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.635 -0.712 . . . . 0.0 111.94 -178.47 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -48.03 138.9 8.63 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.135 -0.939 . . . . 0.0 111.808 179.467 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.545 ' HA ' ' HD2' ' A' ' 86' ' ' LYS . 64.5 t80 -64.22 -41.52 96.98 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.826 -174.714 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 85.1 t60 -70.19 -29.5 66.38 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.863 0.363 . . . . 0.0 110.46 -178.701 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.481 HG21 HD11 ' A' ' 81' ' ' LEU . 25.9 m -69.17 -41.12 77.64 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 175.06 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.545 ' HD2' ' HA ' ' A' ' 83' ' ' PHE . 47.4 mttm -54.77 -46.77 74.45 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.504 171.888 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -52.19 -55.38 21.47 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 114.938 -1.028 . . . . 0.0 110.966 -179.001 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 61.9 t -55.06 -43.19 68.69 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 CA-C-O 121.176 0.513 . . . . 0.0 110.601 -179.317 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 74.3 mt -66.63 -41.63 88.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.949 -178.993 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 68.7 p -66.86 -18.89 65.6 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.0 0.428 . . . . 0.0 110.955 -179.241 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 79.8 m-20 -86.97 -31.6 20.53 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.046 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 22.3 p -107.17 -4.61 18.63 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -175.819 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 8.0 tp -54.3 -28.11 17.89 Favored 'Isoleucine or valine' 0 C--O 1.238 0.493 0 N-CA-C 112.003 0.372 . . . . 0.0 112.003 -174.707 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.497 HG23 ' HG2' ' A' ' 95' ' ' GLN . 3.4 t -55.1 -48.84 73.03 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.752 177.951 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.497 ' HG2' HG23 ' A' ' 94' ' ' THR . 21.8 pt20 -162.19 82.02 1.76 Allowed Pre-proline 0 CA--C 1.532 0.261 0 CA-C-O 121.282 0.563 . . . . 0.0 109.871 -177.84 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -85.26 167.23 10.68 Favored 'Trans proline' 0 CA--C 1.531 0.374 0 C-N-CA 123.012 2.475 . . . . 0.0 113.227 -174.332 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.441 HG22 ' H ' ' A' ' 98' ' ' LEU . 2.9 m -86.34 169.43 12.95 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.109 179.535 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.441 ' H ' HG22 ' A' ' 97' ' ' THR . 3.6 mm? -50.49 -49.41 55.51 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 122.883 0.473 . . . . 0.0 111.852 -176.915 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 99' ' ' HIS . . . . . 0.441 ' ND1' ' HE3' ' A' ' 51' ' ' LYS . 19.1 m-70 -100.82 33.02 2.93 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 120.86 0.362 . . . . 0.0 111.322 -175.813 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 25.2 p -64.74 -50.27 67.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.946 0.403 . . . . 0.0 110.946 179.053 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -78.59 6.15 9.37 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.528 -179.531 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -58.61 -36.67 74.41 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.163 0.506 . . . . 0.0 110.231 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.9 -44.35 91.21 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.454 174.822 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.58 -39.3 90.68 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.464 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.515 ' HG2' ' HB2' ' A' ' 44' ' ' TRP . 0.7 OUTLIER -57.48 -52.1 66.76 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 115.958 -0.564 . . . . 0.0 109.751 176.185 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 25.2 t -61.44 -38.3 86.7 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.847 -178.613 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' ARG . . . . . 0.571 ' O ' ' HG ' ' A' ' 111' ' ' LEU . 36.7 mmt180 -65.51 -57.1 9.06 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.441 -179.334 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.456 ' HA ' HD12 ' A' ' 111' ' ' LEU . 93.3 t -59.95 -40.58 83.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.892 0.377 . . . . 0.0 110.858 -177.856 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 109' ' ' TYR . . . . . 0.51 ' HA ' ' HE1' ' A' ' 112' ' ' MET . 3.6 t80 -56.0 -49.61 73.16 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.198 177.591 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 110' ' ' GLN . . . . . 0.526 ' HG2' ' O ' ' A' ' 107' ' ' ARG . 10.5 pt20 -72.51 -17.73 61.72 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.653 -0.249 . . . . 0.0 111.015 -176.945 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.571 ' HG ' ' O ' ' A' ' 107' ' ' ARG . 73.3 mt -68.39 -58.65 4.04 Favored 'General case' 0 C--O 1.235 0.312 0 O-C-N 123.189 0.305 . . . . 0.0 110.853 178.609 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 112' ' ' MET . . . . . 0.51 ' HE1' ' HA ' ' A' ' 109' ' ' TYR . 0.1 OUTLIER -75.92 -14.41 60.26 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 120.132 -0.627 . . . . 0.0 110.342 -179.002 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 113' ' ' GLU . . . . . 0.598 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 39.3 tt0 -60.91 -61.35 2.64 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.145 0.498 . . . . 0.0 109.761 172.979 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -69.51 5.15 1.47 Allowed 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.816 -0.629 . . . . 0.0 112.595 -173.402 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -129.4 -66.27 0.82 Allowed 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 120.897 0.379 . . . . 0.0 111.302 176.972 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 7.4 m -72.64 -28.12 62.55 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.951 -172.276 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' TYR . . . . . 0.598 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 34.1 t80 -64.89 -46.97 79.51 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 121.219 -0.192 . . . . 0.0 110.691 -179.081 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 31.7 p -64.13 -43.34 95.58 Favored 'General case' 0 C--O 1.239 0.531 0 CA-C-O 121.131 0.491 . . . . 0.0 110.294 179.327 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 51.8 mtt180 -57.33 -42.85 82.71 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.124 175.283 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.423 ' O ' ' HB2' ' A' ' 126' ' ' TYR . 78.4 t80 -61.53 -42.7 99.21 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.385 179.369 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 90.1 mt -60.04 -32.76 71.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.587 -0.279 . . . . 0.0 111.612 -178.359 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 122' ' ' LYS . . . . . 0.726 ' HE2' ' HA ' ' A' ' 122' ' ' LYS . 10.0 mmpt? -110.73 11.49 22.62 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 111.998 0.37 . . . . 0.0 111.998 -179.331 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 79.4 p -74.48 156.55 36.8 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-O 120.797 0.332 . . . . 0.0 110.718 177.745 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -55.63 -30.29 60.71 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.152 175.319 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.478 ' N ' HD12 ' A' ' 125' ' ' ILE . 2.3 mp -63.09 -49.77 82.06 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.218 -178.978 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 126' ' ' TYR . . . . . 0.423 ' HB2' ' O ' ' A' ' 120' ' ' PHE . 71.0 t80 -65.63 -35.41 80.72 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.777 -177.862 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 88.7 mt -66.36 -34.84 78.88 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.914 0.388 . . . . 0.0 109.956 176.543 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -68.86 -33.26 73.51 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.844 -0.616 . . . . 0.0 109.79 175.876 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.475 HD22 HG12 ' A' ' 3' ' ' VAL . 88.6 mt -74.04 -32.66 63.43 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.386 176.104 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 130' ' ' MET . . . . . 0.431 ' HA ' ' CE ' ' A' ' 130' ' ' MET . 7.5 mmt . . . . . 0 CA--C 1.519 -0.246 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.687 176.5 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 2.6 p . . . . . 0 CA--C 1.53 0.206 0 CA-C-O 120.766 0.317 . . . . 0.0 110.459 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.6 m -61.74 141.66 94.99 Favored Pre-proline 0 CA--C 1.534 0.339 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.248 178.585 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -55.22 -35.39 90.99 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 122.564 2.176 . . . . 0.0 111.845 -179.65 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -65.48 -49.36 69.37 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 178.009 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -55.65 -44.32 77.09 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.112 176.524 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.34 -57.03 14.81 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.255 -178.734 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 26.5 m -64.03 -26.06 39.6 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 CA-C-O 120.826 0.346 . . . . 0.0 110.682 -179.506 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 16.3 tppt? -68.86 -30.16 68.62 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.499 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.453 ' HZ2' ' ND1' ' A' ' 21' ' ' HIS . 54.5 m0 -62.1 -31.52 71.98 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 121.058 0.456 . . . . 0.0 109.926 174.529 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -59.79 -16.44 38.54 Favored Glycine 0 C--N 1.335 0.508 0 CA-C-N 115.787 -0.642 . . . . 0.0 113.518 -175.056 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -116.77 3.86 12.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.624 0.249 . . . . 0.0 110.987 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 43.9 m -152.02 98.01 2.39 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 120.871 0.367 . . . . 0.0 111.136 -178.3 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 57.1 t80 -65.2 -36.0 82.82 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 121.313 0.578 . . . . 0.0 109.554 178.157 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -58.93 -32.84 69.93 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.278 -0.873 . . . . 0.0 110.325 177.347 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 22.9 ttmm -72.98 -39.17 66.31 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.0 -0.545 . . . . 0.0 109.86 -179.61 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.497 HD22 ' CE1' ' A' ' 117' ' ' TYR . 14.9 tp -56.18 -50.48 71.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.983 174.499 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 34.4 tp -70.55 -31.57 68.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.133 -0.939 . . . . 0.0 111.524 -175.22 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 38.6 p -81.4 -25.77 35.97 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 120.693 0.282 . . . . 0.0 111.113 -179.697 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.453 ' ND1' ' HZ2' ' A' ' 11' ' ' TRP . 23.8 t-80 -85.29 118.0 24.57 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 179.492 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 39.5 mtm180 -42.24 -54.88 3.52 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.08 0.552 . . . . 0.0 111.751 -177.193 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -57.14 -36.36 70.61 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.265 -179.838 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -71.98 -51.31 14.97 Favored Glycine 0 N--CA 1.451 -0.302 0 N-CA-C 111.674 -0.57 . . . . 0.0 111.674 -178.468 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 7.0 tt -54.03 -48.16 70.79 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.247 -0.476 . . . . 0.0 110.277 176.846 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -61.31 -51.23 69.73 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.632 -179.315 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -60.58 -41.62 95.01 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.326 -177.712 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 77.6 t80 -74.9 -42.17 58.33 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.178 -175.616 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.443 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 10.6 t -64.66 -43.5 93.42 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 120.966 -0.293 . . . . 0.0 110.418 -176.771 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.46 -33.04 74.32 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 121.073 0.463 . . . . 0.0 110.006 179.315 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.468 ' O ' HG22 ' A' ' 34' ' ' THR . 92.4 t80 -65.95 -48.99 69.51 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.499 178.686 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 19.5 tp -68.77 -26.16 65.08 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.102 0.477 . . . . 0.0 110.882 -175.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.543 ' HG2' ' HB3' ' A' ' 38' ' ' GLU . 68.4 mttm -85.26 -1.17 56.65 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.611 -179.419 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.468 HG22 ' O ' ' A' ' 31' ' ' PHE . 3.8 t -69.79 -33.34 72.25 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 120.937 0.398 . . . . 0.0 110.339 179.755 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -118.79 16.73 13.54 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.356 178.751 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 83.5 m-85 60.15 28.89 18.5 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 115.418 -0.81 . . . . 0.0 112.009 176.708 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 21.8 t -82.27 4.71 22.57 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 121.884 0.849 . . . . 0.0 108.779 174.642 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.543 ' HB3' ' HG2' ' A' ' 33' ' ' LYS . 13.7 pt-20 -56.42 -19.31 14.38 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 114.577 -1.192 . . . . 0.0 111.629 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.44 ' O ' ' HB2' ' A' ' 43' ' ' PHE . 10.1 mm-40 -45.77 -33.07 2.84 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.083 179.384 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.517 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 49.7 m-80 -72.63 -47.49 47.23 Favored 'General case' 0 C--O 1.24 0.581 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.552 -178.434 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.513 ' HA ' ' HE1' ' A' ' 112' ' ' MET . 13.6 tt -70.94 -45.41 73.15 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 -177.257 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.474 ' OE1' ' HB2' ' A' ' 38' ' ' GLU . 4.2 mp0 -63.26 -23.27 67.35 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.65 174.318 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.517 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 66.8 t80 -62.09 -60.85 3.0 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 120.471 0.176 . . . . 0.0 110.776 177.632 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.656 ' HB2' ' HG3' ' A' ' 105' ' ' GLN . 13.1 p-90 -72.92 -9.68 58.97 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 119.258 -0.977 . . . . 0.0 111.513 -177.58 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.409 HG13 ' O ' ' A' ' 41' ' ' ILE . 79.8 mt -79.82 -33.22 14.64 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 166.968 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.47 ' HA ' ' OD2' ' A' ' 49' ' ' ASP . . . -67.14 -21.62 65.81 Favored 'General case' 0 CA--C 1.522 -0.105 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.64 179.071 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 44.4 t -68.72 -32.82 72.89 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.731 172.824 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.529 ' O ' ' HG2' ' A' ' 51' ' ' LYS . 17.0 mm-40 -75.17 -49.25 20.06 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.316 179.646 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.51 ' HA ' ' HD3' ' A' ' 52' ' ' LYS . 3.1 p30 -70.32 -11.99 61.28 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.465 177.426 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 24.5 t80 -71.76 -49.2 41.09 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.371 174.201 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.529 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 13.1 ptmm? -62.38 -26.08 68.27 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.891 0.376 . . . . 0.0 109.998 176.855 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.51 ' HD3' ' HA ' ' A' ' 49' ' ' ASP . 51.1 mtpt -67.34 -31.44 71.7 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.674 175.22 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 31.6 m -82.32 51.26 1.77 Allowed 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 121.243 0.544 . . . . 0.0 109.81 178.583 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.77 16.83 0.08 Allowed 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 114.052 1.131 . . . . 0.0 114.052 -170.186 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' GLY . . . . . 0.491 ' O ' HG12 ' A' ' 59' ' ' ILE . . . -65.88 130.64 33.5 Favored Glycine 0 CA--C 1.523 0.569 0 C-N-CA 120.555 -0.831 . . . . 0.0 111.211 175.504 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -50.46 -43.93 42.09 Favored 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 123.058 2.505 . . . . 0.0 113.009 -173.664 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 22.0 tm0? -93.83 -33.15 13.66 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 179.393 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 25.5 tp60 -54.11 -35.6 62.33 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.958 179.391 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.491 HG12 ' O ' ' A' ' 55' ' ' GLY . 27.1 mm -52.77 -42.25 41.5 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.611 176.201 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 22.8 m-70 -65.63 -45.18 84.04 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.52 -177.466 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 91.0 mt -68.03 -43.65 78.28 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.011 -178.504 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.48 ' NZ ' HD11 ' A' ' 66' ' ' ILE . 8.0 tmtt? -66.35 -40.96 90.13 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.512 -177.105 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.9 -41.3 87.39 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.543 176.878 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 14.6 tppt? -53.69 -46.99 70.88 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.723 177.376 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.7 -59.68 4.66 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.579 179.235 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.48 HD11 ' NZ ' ' A' ' 62' ' ' LYS . 66.5 mt -56.73 -35.59 46.28 Favored 'Isoleucine or valine' 0 C--O 1.235 0.336 0 CA-C-O 121.37 0.605 . . . . 0.0 110.522 179.545 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.431 ' OH ' HG22 ' A' ' 90' ' ' THR . 83.1 t80 -62.8 -67.68 0.4 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.171 -176.803 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.505 ' HA ' ' HB2' ' A' ' 72' ' ' GLN . 29.1 mt-10 -77.43 -1.81 32.1 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 -172.909 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 65.8 tttp -100.57 -28.73 12.73 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 116.865 -0.152 . . . . 0.0 111.334 177.486 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' PHE . . . . . 0.438 ' HB3' HG23 ' A' ' 79' ' ' VAL . 75.0 m-85 -132.86 -43.98 0.88 Allowed 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -175.657 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 45.5 mm -77.0 -36.59 25.2 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 CA-C-O 120.698 0.285 . . . . 0.0 111.691 -173.643 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.505 ' HB2' ' HA ' ' A' ' 68' ' ' GLU . 60.0 tp60 -59.25 133.66 56.3 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.829 -175.194 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 37.1 p -61.95 124.06 19.74 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.017 177.684 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 26.9 t70 70.99 29.9 2.88 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.117 -178.597 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.442 ' HB1' ' HD2' ' A' ' 76' ' ' PRO . . . -63.65 164.91 13.71 Favored Pre-proline 0 CA--C 1.537 0.445 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.724 171.682 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.442 ' HD2' ' HB1' ' A' ' 75' ' ' ALA . 84.7 Cg_exo -45.18 -57.61 2.02 Favored 'Trans proline' 0 C--N 1.356 0.955 0 C-N-CA 122.499 2.133 . . . . 0.0 111.915 178.834 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.1 72.66 1.47 Allowed 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 171.736 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -68.05 146.76 53.2 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.184 -178.289 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.479 HG11 HG22 ' A' ' 108' ' ' VAL . 53.5 t -85.02 147.05 5.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 176.982 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 46.7 m-80 -77.86 51.8 0.98 Allowed 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 121.606 0.717 . . . . 0.0 110.151 177.723 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.407 HD11 HG21 ' A' ' 85' ' ' THR . 44.8 tp -73.79 147.22 43.62 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.001 -0.999 . . . . 0.0 110.351 178.863 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -50.34 139.98 14.24 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.431 178.724 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 47.8 p90 -64.79 -37.35 87.33 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.945 -176.26 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' HIS . . . . . 0.421 ' O ' ' HB3' ' A' ' 87' ' ' GLU . 72.4 t60 -69.16 -36.61 77.59 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.81 0.338 . . . . 0.0 110.379 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.407 HG21 HD11 ' A' ' 81' ' ' LEU . 38.7 m -66.86 -43.99 82.14 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.121 176.831 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.446 ' O ' HG23 ' A' ' 90' ' ' THR . 95.7 mttt -60.82 -38.56 85.85 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 174.831 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.421 ' HB3' ' O ' ' A' ' 84' ' ' HIS . 43.2 tt0 -56.52 -50.19 72.56 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.41 177.719 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.413 HG23 ' O ' ' A' ' 84' ' ' HIS . 96.2 t -62.42 -51.15 75.85 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.797 179.079 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 71.4 mt -57.73 -49.29 81.29 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.273 -176.954 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.446 HG23 ' O ' ' A' ' 86' ' ' LYS . 49.1 p -57.66 -39.98 78.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.166 0.507 . . . . 0.0 111.083 -178.473 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 32.9 m-80 -85.61 -4.87 59.28 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.983 -176.867 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 15.3 m -124.88 0.84 8.04 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.7 tp -66.63 -23.01 30.6 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 CA-C-O 120.761 0.315 . . . . 0.0 111.459 -174.006 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.554 HG23 ' HG2' ' A' ' 95' ' ' GLN . 15.4 t -63.03 -25.31 68.32 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.981 179.298 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.554 ' HG2' HG23 ' A' ' 94' ' ' THR . 11.4 pt20 -151.83 77.25 7.11 Favored Pre-proline 0 CA--C 1.536 0.412 0 CA-C-O 121.236 0.541 . . . . 0.0 110.503 179.596 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' PRO . . . . . 0.475 ' HG2' HG22 ' A' ' 59' ' ' ILE . 96.4 Cg_endo -88.69 159.31 6.32 Favored 'Trans proline' 0 N--CA 1.461 -0.418 0 C-N-CA 122.768 2.312 . . . . 0.0 112.214 179.134 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.485 ' H ' ' HB2' ' A' ' 100' ' ' SER . 18.5 p -96.3 172.28 8.05 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.938 176.355 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 10.4 mp -53.29 -30.32 38.07 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 -174.029 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -133.2 31.71 3.79 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.907 0.384 . . . . 0.0 110.513 -176.458 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' SER . . . . . 0.485 ' HB2' ' H ' ' A' ' 97' ' ' THR . 23.5 t -54.68 -26.02 30.8 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.82 -177.321 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -83.68 17.9 2.11 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.438 -178.703 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -56.94 -50.13 73.53 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.917 0.389 . . . . 0.0 110.965 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.7 -47.97 83.53 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.671 179.074 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.404 ' O ' HG23 ' A' ' 108' ' ' VAL . . . -60.52 -36.81 79.29 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.532 178.983 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.656 ' HG3' ' HB2' ' A' ' 44' ' ' TRP . 57.3 tt0 -57.29 -44.16 83.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.185 -179.246 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 14.4 m -69.36 -41.72 76.2 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.762 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' ARG . . . . . 0.483 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 38.4 mmt180 -60.03 -43.94 94.98 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.365 -178.119 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.479 HG22 HG11 ' A' ' 79' ' ' VAL . 83.4 t -69.22 -43.4 81.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.95 0.405 . . . . 0.0 111.068 -177.655 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 25.0 t80 -56.8 -46.22 81.73 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.376 179.293 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' GLN . . . . . 0.483 ' HG3' ' O ' ' A' ' 107' ' ' ARG . 5.3 pp0? -70.11 -36.46 74.86 Favored 'General case' 0 C--O 1.238 0.485 0 N-CA-C 111.677 0.251 . . . . 0.0 111.677 -175.819 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.484 ' HA ' ' HG2' ' A' ' 114' ' ' GLN . 4.5 pp -74.0 -28.05 61.26 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 120.815 -0.354 . . . . 0.0 110.269 179.415 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 112' ' ' MET . . . . . 0.513 ' HE1' ' HA ' ' A' ' 41' ' ' ILE . 44.2 ttm -61.89 -39.63 92.61 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.563 175.162 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 113' ' ' GLU . . . . . 0.455 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 3.2 tm-20 -59.79 -60.88 3.13 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.624 -0.717 . . . . 0.0 110.164 177.56 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 114' ' ' GLN . . . . . 0.484 ' HG2' ' HA ' ' A' ' 111' ' ' LEU . 13.7 pt20 -64.63 -18.13 64.65 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -173.072 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -110.28 -67.27 1.0 Allowed 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.138 0.494 . . . . 0.0 111.71 -179.542 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 17.4 m -72.5 -31.45 65.37 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.696 -172.589 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' TYR . . . . . 0.497 ' CE1' HD22 ' A' ' 18' ' ' LEU . 18.3 t80 -81.72 -36.91 28.09 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.175 -0.61 . . . . 0.0 110.924 -177.602 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 22.0 p -60.04 -47.49 85.65 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-O 120.905 0.384 . . . . 0.0 110.45 178.353 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 14.7 ptp180 -61.49 -36.07 79.44 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 176.025 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -65.56 -33.84 76.85 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.557 177.343 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 86.3 mt -65.15 -28.69 69.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.028 0.442 . . . . 0.0 110.196 176.736 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 3.7 tppp? -93.44 -9.86 37.08 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.379 179.157 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 60.7 p -59.85 146.84 40.52 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-O 121.153 0.501 . . . . 0.0 111.578 -176.301 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -59.73 -38.03 80.56 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.173 179.31 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.456 ' O ' ' HG ' ' A' ' 129' ' ' LEU . 0.0 OUTLIER -64.49 -47.04 90.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.66 -176.922 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -66.38 -48.35 70.4 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 120.877 0.37 . . . . 0.0 111.132 -177.827 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 95.5 mt -63.37 -29.59 70.87 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.871 -179.576 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -67.79 -39.23 84.04 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.668 177.079 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 125' ' ' ILE . 97.8 mt -61.15 -47.86 84.24 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.988 -179.103 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 130' ' ' MET . . . . . . . . . . . . . 14.8 ptp . . . . . 0 C--N 1.33 -0.24 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.249 -178.846 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 6.8 p . . . . . 0 C--O 1.234 0.243 0 CA-C-O 120.89 0.376 . . . . 0.0 111.56 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 17.3 m -100.17 148.19 34.54 Favored Pre-proline 0 CA--C 1.535 0.383 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.743 175.712 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo -49.27 -44.22 34.68 Favored 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 123.057 2.505 . . . . 0.0 113.232 -177.739 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.439 ' HA ' HG22 ' A' ' 9' ' ' VAL . 32.6 mt-10 -70.61 -24.38 62.73 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.222 -177.175 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.404 ' O ' ' HB3' ' A' ' 10' ' ' LYS . 21.2 tp10 -73.21 -34.33 65.88 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 173.187 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.745 ' HB3' ' SD ' ' A' ' 130' ' ' MET . . . -66.68 -42.22 86.85 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.048 179.789 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.439 HG22 ' HA ' ' A' ' 6' ' ' GLU . 27.1 m -68.26 -25.69 32.2 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 CA-C-O 120.971 0.415 . . . . 0.0 110.195 175.594 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.404 ' HB3' ' O ' ' A' ' 7' ' ' GLU . 16.9 tppt? -69.58 -27.86 65.48 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.007 174.074 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 46.8 m0 -72.15 -35.27 69.02 Favored 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 171.887 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -69.0 -2.64 32.03 Favored Glycine 0 N--CA 1.452 -0.298 0 CA-C-N 115.15 -0.932 . . . . 0.0 113.568 -176.882 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -115.42 4.44 14.33 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 117.048 0.424 . . . . 0.0 110.507 176.778 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.1 p -161.46 92.95 0.91 Allowed 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 121.039 0.447 . . . . 0.0 111.101 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.413 ' CE1' HD23 ' A' ' 18' ' ' LEU . 13.1 t80 -58.27 -38.6 77.28 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.007 177.851 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -48.88 -42.07 35.47 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.389 173.653 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -76.12 -27.37 57.05 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.26 -178.473 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.413 HD23 ' CE1' ' A' ' 15' ' ' PHE . 52.8 tp -59.15 -43.27 92.04 Favored 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 110.054 -0.35 . . . . 0.0 110.054 179.008 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -75.31 -32.02 60.84 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.374 176.547 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 43.3 t -61.72 -35.3 77.64 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.476 178.093 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -80.56 115.08 19.89 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 177.195 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.31 -44.3 54.05 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 121.254 0.549 . . . . 0.0 110.583 177.084 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -72.39 -28.23 62.86 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.827 -178.507 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -71.01 -44.83 54.2 Favored Glycine 0 N--CA 1.451 -0.324 0 N-CA-C 111.063 -0.815 . . . . 0.0 111.063 177.084 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.3 tt -62.57 -41.46 98.95 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.923 -0.639 . . . . 0.0 110.481 177.575 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.498 ' O ' ' HG2' ' A' ' 30' ' ' ARG . 43.6 tt0 -58.84 -47.84 83.43 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.876 0.37 . . . . 0.0 110.211 177.473 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -63.61 -40.86 98.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.963 0.411 . . . . 0.0 110.78 179.241 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 73.2 t80 -64.53 -45.4 87.36 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.071 -177.202 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.531 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 9.7 t -66.54 -41.67 88.35 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 120.91 -0.316 . . . . 0.0 110.558 -179.451 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.498 ' HG2' ' O ' ' A' ' 26' ' ' GLU . 12.1 mmt180 -54.1 -36.01 62.76 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 120.994 0.426 . . . . 0.0 110.395 178.651 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.454 ' O ' HG22 ' A' ' 34' ' ' THR . 63.4 t80 -70.62 -53.73 14.76 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.543 175.579 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 28.2 tp -64.07 -24.1 67.58 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.91 -173.181 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.531 ' HG3' ' O ' ' A' ' 29' ' ' THR . 68.5 mttm -65.02 -14.05 59.43 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 116.749 -0.205 . . . . 0.0 111.336 179.58 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.454 HG22 ' O ' ' A' ' 31' ' ' PHE . 14.3 t -62.82 -34.51 77.46 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 120.851 0.358 . . . . 0.0 110.7 179.275 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -115.76 7.94 14.75 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.13 -175.99 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 92.5 m-85 59.54 17.09 5.79 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 115.942 -0.572 . . . . 0.0 112.542 173.595 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 8.4 t -86.86 27.57 0.99 Allowed 'General case' 0 C--O 1.235 0.3 0 CA-C-O 121.63 0.729 . . . . 0.0 109.638 -179.16 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 64.6 tt0 -71.83 -13.62 61.73 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.956 -177.177 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.469 ' HB3' ' HB3' ' A' ' 77' ' ' LYS . 0.8 OUTLIER -55.74 -26.61 46.39 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 111.704 0.261 . . . . 0.0 111.704 -178.354 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.411 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 57.3 m-80 -61.65 -50.15 73.68 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-O 121.625 0.726 . . . . 0.0 109.944 173.883 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 61.7 mt -63.5 -49.72 81.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.935 178.983 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -57.96 -30.87 66.35 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.805 177.998 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.411 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 79.1 t80 -58.69 -63.23 1.36 Allowed 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.502 179.733 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.581 ' HA ' ' SG ' ' A' ' 47' ' ' CYS . 6.2 p-90 -79.05 -5.99 55.34 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 119.545 -0.862 . . . . 0.0 112.148 -178.778 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 8.8 mt -69.37 -45.88 77.91 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 166.335 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.45 -32.04 73.49 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.326 177.266 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.581 ' SG ' ' HA ' ' A' ' 44' ' ' TRP . 73.6 m -64.35 -30.72 71.76 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.801 177.965 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.463 ' HG3' ' HE3' ' A' ' 51' ' ' LYS . 39.8 tt0 -77.0 -40.86 45.14 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 178.011 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -61.44 -31.64 71.59 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 121.525 0.679 . . . . 0.0 109.671 173.531 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.462 ' CZ ' HG23 ' A' ' 59' ' ' ILE . 56.4 t80 -65.36 -52.67 52.12 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 114.911 -1.04 . . . . 0.0 111.162 178.709 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.463 ' HE3' ' HG3' ' A' ' 48' ' ' GLU . 0.0 OUTLIER -68.87 -21.49 64.26 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 121.347 0.594 . . . . 0.0 110.028 179.749 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 8.8 tttm -69.68 -19.71 63.58 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.271 173.363 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 15.5 m -84.29 43.66 0.97 Allowed 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.517 179.041 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.19 98.47 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.678 0.752 . . . . 0.0 112.407 -177.477 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' GLY . . . . . 0.515 ' O ' HG12 ' A' ' 59' ' ' ILE . . . -179.91 129.15 1.3 Allowed Glycine 0 C--O 1.226 -0.392 0 N-CA-C 110.624 -0.99 . . . . 0.0 110.624 176.943 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_endo -46.29 -58.23 1.79 Allowed 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.951 2.434 . . . . 0.0 112.997 -172.554 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -71.16 -38.15 72.19 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 120.978 0.418 . . . . 0.0 110.543 -178.566 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.585 ' OE1' HD11 ' A' ' 61' ' ' LEU . 5.4 tp-100 -57.46 -42.31 82.32 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.489 -178.357 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.515 HG12 ' O ' ' A' ' 55' ' ' GLY . 36.9 mm -58.46 -47.12 89.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.312 -178.69 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 13.1 m80 -64.76 -46.04 83.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.277 -174.499 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.585 HD11 ' OE1' ' A' ' 58' ' ' GLN . 4.5 pp -71.59 -33.23 68.86 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.127 -176.928 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.476 ' N ' HD12 ' A' ' 61' ' ' LEU . 12.3 mmmm -68.55 -42.67 78.05 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 110.095 -0.335 . . . . 0.0 110.095 176.061 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.22 -39.48 90.41 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.372 177.305 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.478 ' O ' ' HB3' ' A' ' 67' ' ' TYR . 4.0 tmtp? -65.3 -38.22 89.53 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.898 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -65.36 -49.85 67.78 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.137 0.494 . . . . 0.0 110.303 177.471 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 70.8 mt -61.66 -30.65 48.74 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.069 177.128 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.542 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 78.2 t80 -58.85 -58.32 9.14 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.494 178.334 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -70.09 -26.65 64.08 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.88 -0.6 . . . . 0.0 112.095 -172.61 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 35.2 ttpt -99.87 -28.31 13.18 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 -174.905 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -120.27 -45.27 2.45 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -176.266 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.542 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 44.2 mm -76.64 -22.6 15.12 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 CA-C-O 120.573 0.225 . . . . 0.0 110.984 -173.852 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.502 ' HG3' ' H ' ' A' ' 74' ' ' ASP . 6.3 tp60 -50.54 148.18 4.02 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.735 176.601 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 26.1 m -57.48 -42.85 83.47 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.267 -179.629 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ASP . . . . . 0.502 ' H ' ' HG3' ' A' ' 72' ' ' GLN . 6.7 m-20 -82.88 -72.4 0.45 Allowed 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.281 -179.44 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . 69.24 134.71 0.04 OUTLIER Pre-proline 0 CA--C 1.535 0.403 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.761 -177.836 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -59.33 -35.76 96.05 Favored 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 122.587 2.191 . . . . 0.0 112.044 -178.39 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.469 ' HB3' ' HB3' ' A' ' 39' ' ' GLU . 14.1 mmmm -87.88 -15.61 36.24 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.575 178.964 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 58.73 83.14 0.13 Allowed 'General case' 0 C--O 1.236 0.387 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.018 -177.903 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.447 HG12 ' H ' ' A' ' 81' ' ' LEU . 35.9 t -80.93 140.74 16.18 Favored 'Isoleucine or valine' 0 C--O 1.234 0.275 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.48 -176.679 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -88.54 11.26 17.7 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.118 -0.492 . . . . 0.0 112.025 -172.976 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.49 HD11 HG21 ' A' ' 85' ' ' THR . 25.7 tp -59.15 145.0 44.09 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -175.336 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.455 ' O ' ' HG3' ' A' ' 86' ' ' LYS . 10.9 t70 -55.64 145.33 23.92 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 115.044 -0.98 . . . . 0.0 112.543 -177.76 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 45.7 p90 -67.3 -42.46 83.69 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.812 -175.876 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' HIS . . . . . 0.492 ' O ' ' HB3' ' A' ' 87' ' ' GLU . 69.4 t60 -69.15 -29.51 67.56 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.898 0.38 . . . . 0.0 110.341 -177.849 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.536 ' OG1' ' HG3' ' A' ' 107' ' ' ARG . 22.1 m -67.15 -45.97 75.48 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 176.589 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.455 ' HG3' ' O ' ' A' ' 82' ' ' ASP . 26.3 mtpp -56.65 -39.08 73.08 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 109.26 -0.645 . . . . 0.0 109.26 175.24 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.492 ' HB3' ' O ' ' A' ' 84' ' ' HIS . 56.1 tt0 -58.18 -53.83 53.89 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.601 177.639 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 84' ' ' HIS . 96.9 t -55.14 -43.2 69.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.071 0.462 . . . . 0.0 110.312 179.446 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.405 HG13 ' O ' ' A' ' 85' ' ' THR . 73.9 mt -65.25 -42.43 93.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.091 -179.394 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 41.1 p -64.38 -18.39 64.63 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 120.93 0.395 . . . . 0.0 111.031 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 47.6 m-80 -88.85 -41.56 12.4 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.564 174.472 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 22.8 t -87.83 0.54 55.66 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.572 -174.74 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 8.9 tp -57.12 -29.1 31.04 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.383 0 CA-C-O 120.945 0.402 . . . . 0.0 111.143 -179.243 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 9.0 t -68.27 -33.88 75.17 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.826 179.406 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 75.5 mm-40 -139.25 80.32 23.49 Favored Pre-proline 0 C--O 1.234 0.276 0 CA-C-O 120.988 0.423 . . . . 0.0 110.955 -178.067 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' PRO . . . . . 0.498 ' HG2' HG22 ' A' ' 59' ' ' ILE . 89.5 Cg_endo -85.72 133.63 4.42 Favored 'Trans proline' 0 N--CA 1.46 -0.461 0 C-N-CA 122.685 2.257 . . . . 0.0 111.774 174.36 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.435 ' N ' ' HB2' ' A' ' 100' ' ' SER . 9.5 p -83.22 176.2 9.35 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.71 176.676 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.439 ' H ' HD22 ' A' ' 98' ' ' LEU . 3.4 mm? -52.14 -45.98 65.2 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.042 0.448 . . . . 0.0 111.229 -175.108 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 7.7 t-80 -116.78 31.85 6.5 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.754 -176.58 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' SER . . . . . 0.435 ' HB2' ' N ' ' A' ' 97' ' ' THR . 20.8 t -45.87 -40.09 9.51 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.633 -0.712 . . . . 0.0 112.683 -172.797 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 -76.04 16.5 0.42 Allowed 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 112.001 0.371 . . . . 0.0 112.001 -177.131 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -58.47 -46.99 85.48 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 121.08 0.466 . . . . 0.0 110.786 178.746 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.409 ' O ' ' HG2' ' A' ' 107' ' ' ARG . . . -58.78 -42.89 90.06 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.403 178.568 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.0 -36.71 85.28 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.649 179.54 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 19.9 tm0? -57.56 -51.44 69.48 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.419 177.327 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' SER . . . . . 0.659 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 31.4 t -57.3 -48.55 78.64 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.211 179.655 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 107' ' ' ARG . . . . . 0.536 ' HG3' ' OG1' ' A' ' 85' ' ' THR . 24.9 mmt180 -53.42 -54.85 30.93 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.317 -179.337 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.527 ' HA ' HD12 ' A' ' 111' ' ' LEU . 98.7 t -60.16 -40.21 82.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.563 -179.604 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 109' ' ' TYR . . . . . 0.599 ' HA ' ' SD ' ' A' ' 112' ' ' MET . 28.5 t80 -57.25 -41.21 79.18 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.147 178.718 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 110' ' ' GLN . . . . . 0.659 ' HG3' ' O ' ' A' ' 106' ' ' SER . 48.9 mt-30 -63.46 -39.94 95.81 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 121.55 0.69 . . . . 0.0 109.816 178.659 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.535 ' HG ' ' O ' ' A' ' 107' ' ' ARG . 93.9 mt -59.33 -49.11 79.09 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 114.581 -1.191 . . . . 0.0 111.934 -173.16 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 112' ' ' MET . . . . . 0.599 ' SD ' ' HA ' ' A' ' 109' ' ' TYR . 0.0 OUTLIER -91.07 -5.62 54.95 Favored 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 120.364 -0.534 . . . . 0.0 110.956 -179.188 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 113' ' ' GLU . . . . . 0.632 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 42.3 tt0 -69.97 -66.43 0.59 Allowed 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 174.496 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 28.3 pt20 -51.85 -31.73 29.06 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.579 -177.825 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -98.65 -72.15 0.66 Allowed 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.653 -177.003 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 14.4 m -71.27 -31.46 67.52 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -168.772 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' TYR . . . . . 0.632 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 15.7 t80 -64.48 -57.34 9.5 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 117.829 0.286 . . . . 0.0 110.633 -178.55 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 39.5 p -60.09 -46.65 88.88 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 121.372 0.606 . . . . 0.0 110.327 179.1 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 20.5 ttp85 -61.0 -31.3 70.91 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.831 178.633 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 86.0 t80 -70.87 -39.73 72.71 Favored 'General case' 0 C--O 1.225 -0.218 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 177.09 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 87.9 mt -62.34 -22.53 66.15 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.932 0.396 . . . . 0.0 110.403 178.023 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -101.44 -11.98 18.93 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.998 177.299 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 82.7 p -65.44 144.59 56.96 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 120.662 0.268 . . . . 0.0 111.013 -175.322 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -57.62 -31.14 65.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.214 177.076 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 2.3 mp -52.71 -53.18 21.99 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 CA-C-O 121.298 0.57 . . . . 0.0 110.254 175.62 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -61.91 -48.3 81.09 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.597 -178.114 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.477 ' HA ' ' HB2' ' A' ' 130' ' ' MET . 3.9 mm? -68.05 -20.35 64.97 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.106 -179.507 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -76.92 -26.27 53.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.065 0.46 . . . . 0.0 110.192 177.154 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 70.8 mt -82.49 -34.86 27.85 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 107.268 -1.382 . . . . 0.0 107.268 175.772 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 130' ' ' MET . . . . . 0.745 ' SD ' ' HB3' ' A' ' 8' ' ' ALA . 83.2 mmm . . . . . 0 N--CA 1.442 -0.855 0 CA-C-N 113.272 -1.785 . . . . 0.0 110.656 178.66 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.474 HG23 ' HB3' ' A' ' 7' ' ' GLU . 1.5 p . . . . . 0 CA--C 1.532 0.257 0 CA-C-O 121.122 0.487 . . . . 0.0 111.349 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 45.1 t -80.73 154.46 73.39 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.536 175.538 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_endo -48.12 -36.64 29.0 Favored 'Trans proline' 0 C--N 1.353 0.773 0 C-N-CA 122.701 2.268 . . . . 0.0 112.108 176.188 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.501 ' O ' ' HG2' ' A' ' 10' ' ' LYS . 33.5 mt-10 -70.28 -32.36 70.13 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 121.282 0.563 . . . . 0.0 110.543 178.421 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.474 ' HB3' HG23 ' A' ' 3' ' ' VAL . 18.9 tp10 -71.99 -32.63 67.4 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 176.583 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.94 -46.53 84.3 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.855 178.553 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.458 HG22 ' O ' ' A' ' 6' ' ' GLU . 19.8 m -66.45 -26.65 38.17 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.23 0 C-N-CA 121.054 -0.258 . . . . 0.0 110.491 179.026 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.501 ' HG2' ' O ' ' A' ' 6' ' ' GLU . 74.2 mmtt -62.81 -44.32 96.46 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.952 0.406 . . . . 0.0 110.016 172.334 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 39.0 m0 -64.49 -27.61 69.1 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.27 0.557 . . . . 0.0 109.863 176.615 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -76.99 -14.51 82.56 Favored Glycine 0 N--CA 1.449 -0.499 0 CA-C-N 115.326 -0.852 . . . . 0.0 112.647 178.47 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -69.84 -50.83 38.88 Favored 'General case' 0 CA--C 1.521 -0.173 0 CA-C-O 121.203 0.525 . . . . 0.0 110.279 178.129 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 28.6 m -152.45 134.07 14.61 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.602 -175.073 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.43 ' CE1' HD23 ' A' ' 18' ' ' LEU . 1.7 t80 -60.29 -35.06 74.71 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.478 -178.205 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -65.03 -32.98 74.97 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.459 179.874 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 4.3 ttmp? -65.95 -38.46 88.64 Favored 'General case' 0 N--CA 1.464 0.253 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 177.146 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.43 HD23 ' CE1' ' A' ' 15' ' ' PHE . 56.5 tp -58.22 -46.81 85.2 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.947 174.677 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.418 ' HG ' ' HH2' ' A' ' 44' ' ' TRP . 6.7 mp -62.77 -37.56 87.14 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.191 177.631 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 52.4 m -73.06 -11.7 60.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.341 -177.531 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -98.26 114.18 26.37 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 179.549 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 10.7 mmt85 -50.27 -48.53 54.78 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.091 0.472 . . . . 0.0 111.129 177.981 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -69.25 -19.25 63.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.511 -179.652 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -80.47 -44.67 8.47 Favored Glycine 0 C--N 1.334 0.436 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.594 178.536 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.41 HD11 HD12 ' A' ' 45' ' ' ILE . 7.1 tp -50.51 -51.66 45.49 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.542 0.686 . . . . 0.0 109.913 173.2 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.431 ' O ' ' HG3' ' A' ' 30' ' ' ARG . 9.0 tp10 -58.93 -52.99 63.36 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.603 -1.18 . . . . 0.0 110.703 -178.965 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -58.38 -39.54 79.9 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.993 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -67.11 -49.26 65.55 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.801 -178.487 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.501 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 14.6 t -66.2 -36.68 83.7 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 110.363 -0.236 . . . . 0.0 110.363 -177.254 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.431 ' HG3' ' O ' ' A' ' 26' ' ' GLU . 62.9 mtp180 -57.52 -41.9 81.75 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 120.888 0.375 . . . . 0.0 110.513 176.889 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.568 ' O ' HG22 ' A' ' 34' ' ' THR . 51.3 t80 -72.64 -43.79 62.74 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.453 176.621 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.489 HD21 ' OD1' ' A' ' 40' ' ' ASN . 19.4 tp -62.08 -28.56 69.7 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.184 -174.975 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.573 ' HG2' ' HB3' ' A' ' 38' ' ' GLU . 99.2 mttt -79.78 -4.87 53.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.534 -179.583 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.568 HG22 ' O ' ' A' ' 31' ' ' PHE . 1.0 OUTLIER -84.62 -17.74 37.7 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 176.039 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -113.44 0.73 14.83 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.747 177.566 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 48.0 t80 68.28 16.79 9.33 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.804 174.708 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 31.7 m -85.28 9.17 16.03 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 121.099 0.476 . . . . 0.0 110.327 177.099 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.573 ' HB3' ' HG2' ' A' ' 33' ' ' LYS . 10.0 pt-20 -56.31 -19.31 13.76 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.429 -0.805 . . . . 0.0 112.454 -177.515 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -50.04 -37.92 35.46 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.341 -179.744 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.536 ' ND2' ' HB3' ' A' ' 112' ' ' MET . 28.6 p30 -81.23 -39.04 25.98 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-N 115.934 -0.576 . . . . 0.0 112.224 -172.272 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.454 HG22 ' O ' ' A' ' 38' ' ' GLU . 9.8 tp -65.8 -43.64 93.26 Favored 'Isoleucine or valine' 0 C--O 1.234 0.254 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 -179.419 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.41 ' HA ' HG22 ' A' ' 45' ' ' ILE . 0.6 OUTLIER -66.32 -31.8 72.81 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.735 176.359 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.424 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 81.7 t80 -55.11 -70.19 0.11 Allowed 'General case' 0 C--O 1.238 0.491 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.558 179.805 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.418 ' HH2' ' HG ' ' A' ' 19' ' ' LEU . 28.4 p-90 -81.72 -15.82 53.15 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 119.854 -0.738 . . . . 0.0 112.67 -171.418 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.41 HD12 HD11 ' A' ' 25' ' ' LEU . 10.8 tt -67.13 -35.76 75.15 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 173.451 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.49 -36.64 83.24 Favored 'General case' 0 N--CA 1.456 -0.128 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.574 173.546 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 72.8 m -66.32 -24.62 66.56 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.075 176.678 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.528 ' HA ' ' HB2' ' A' ' 51' ' ' LYS . 12.6 mm-40 -83.37 -22.87 32.67 Favored 'General case' 0 C--O 1.233 0.218 0 O-C-N 122.272 -0.268 . . . . 0.0 110.556 175.644 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.426 ' HA ' ' HG2' ' A' ' 52' ' ' LYS . 24.5 t70 -68.06 -42.56 80.28 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 168.327 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.423 ' CE1' HG23 ' A' ' 59' ' ' ILE . 6.3 t80 -57.02 -32.87 66.61 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.711 -1.132 . . . . 0.0 110.197 170.282 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.528 ' HB2' ' HA ' ' A' ' 48' ' ' GLU . 0.0 OUTLIER -73.45 -40.42 64.19 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.297 -176.905 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.426 ' HG2' ' HA ' ' A' ' 49' ' ' ASP . 7.0 ptmm? -74.78 -26.63 59.88 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 120.579 0.228 . . . . 0.0 111.154 179.667 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 28.8 p -77.84 67.34 3.69 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-O 121.174 0.512 . . . . 0.0 109.691 175.412 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.491 ' NZ ' ' HB2' ' A' ' 54' ' ' LYS . 0.0 OUTLIER -77.08 16.96 0.49 Allowed 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.387 -0.824 . . . . 0.0 113.162 -170.937 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -68.94 133.78 27.06 Favored Glycine 0 CA--C 1.52 0.398 0 C-N-CA 120.451 -0.881 . . . . 0.0 110.937 176.052 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -54.21 -42.1 70.25 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.729 2.286 . . . . 0.0 112.642 -174.177 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -89.07 -29.1 19.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.17 0.51 . . . . 0.0 109.908 179.005 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.489 ' OE1' HD11 ' A' ' 61' ' ' LEU . 4.7 tp-100 -56.23 -42.25 76.99 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.714 178.296 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.423 HG23 ' CE1' ' A' ' 50' ' ' PHE . 29.9 mm -54.58 -39.6 46.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.308 178.295 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 21.9 m80 -66.02 -52.06 52.67 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.185 -175.903 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.489 HD11 ' OE1' ' A' ' 58' ' ' GLN . 4.6 pp -69.74 -32.21 70.62 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.964 -177.459 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.489 ' N ' HD12 ' A' ' 61' ' ' LEU . 66.6 mmtt -66.69 -43.65 83.83 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 121.174 0.512 . . . . 0.0 109.997 174.91 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.22 -47.54 85.55 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.952 -179.797 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 3.5 tppp? -63.66 -35.37 80.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.502 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.83 -53.27 59.9 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.048 0.451 . . . . 0.0 110.401 177.661 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 65.5 mt -62.9 -37.62 79.71 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.392 178.154 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.549 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 71.9 t80 -57.21 -56.87 16.22 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.735 -179.487 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.458 ' HA ' ' HG2' ' A' ' 72' ' ' GLN . 42.8 mt-10 -70.69 -30.09 66.57 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.529 -175.203 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 58.2 tttm -90.9 -19.04 23.78 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.723 -173.581 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 99.4 m-85 -136.35 -53.2 0.73 Allowed 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -176.052 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.549 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 45.7 mm -73.1 -24.09 20.58 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -167.433 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.458 ' HG2' ' HA ' ' A' ' 68' ' ' GLU . 13.5 mm-40 -53.67 139.88 30.91 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 120.851 0.358 . . . . 0.0 111.244 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 65.2 m -71.97 69.68 0.73 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.609 0.719 . . . . 0.0 110.089 176.25 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 21.2 t70 170.59 -76.69 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 107.406 -1.331 . . . . 0.0 107.406 -178.274 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.406 ' HA ' ' HD3' ' A' ' 76' ' ' PRO . . . 59.95 149.07 0.08 OUTLIER Pre-proline 0 CA--C 1.538 0.493 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 169.622 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 75' ' ' ALA . 21.3 Cg_exo -67.43 -20.07 48.5 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 122.508 2.139 . . . . 0.0 111.625 173.815 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.757 ' HA ' ' HE2' ' A' ' 77' ' ' LYS . 11.2 mmpt? -105.25 -19.7 13.73 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.149 -179.379 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 52.19 77.98 0.14 Allowed 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 121.317 0.58 . . . . 0.0 110.082 -175.704 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 59.0 t -84.94 117.52 30.35 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.95 -175.605 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -80.23 77.39 6.97 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.35 0.595 . . . . 0.0 110.35 179.261 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 20.5 tp -110.75 148.06 33.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.891 176.883 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -49.57 128.61 17.92 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.285 -178.271 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.412 ' O ' ' HG2' ' A' ' 86' ' ' LYS . 38.2 p90 -52.19 -42.78 63.79 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.412 -179.78 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' HIS . . . . . 0.442 ' O ' HG23 ' A' ' 88' ' ' VAL . 68.7 t60 -68.07 -39.7 82.91 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.674 -0.239 . . . . 0.0 110.88 -178.385 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 40.6 m -63.71 -46.49 85.24 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.917 0.389 . . . . 0.0 110.547 -179.26 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.412 ' HG2' ' O ' ' A' ' 83' ' ' PHE . 12.0 ptmm? -72.12 -21.95 61.4 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.153 179.688 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -69.92 -46.54 65.14 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.227 174.966 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 84' ' ' HIS . 87.6 t -54.84 -36.98 39.3 Favored 'Isoleucine or valine' 0 C--O 1.235 0.32 0 CA-C-O 121.287 0.565 . . . . 0.0 109.61 175.242 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.409 HD12 ' HA ' ' A' ' 86' ' ' LYS . 74.4 mt -63.15 -46.48 95.84 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.71 176.304 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 72.1 p -63.94 -22.57 66.98 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.067 0.46 . . . . 0.0 111.094 -179.215 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 79.6 m-20 -85.6 -31.1 22.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.542 178.715 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 20.7 m -98.2 -1.84 41.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.469 -176.913 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 11.0 tp -66.33 -15.01 18.47 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 CA-C-O 121.106 0.479 . . . . 0.0 111.238 -176.839 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 8.0 t -89.3 -6.95 56.31 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.909 178.487 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.489 ' N ' ' HD3' ' A' ' 96' ' ' PRO . 25.5 pt20 -160.79 56.92 0.81 Allowed Pre-proline 0 CA--C 1.536 0.43 0 CA-C-O 120.973 0.416 . . . . 0.0 110.495 -179.132 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' PRO . . . . . 0.489 ' HD3' ' N ' ' A' ' 95' ' ' GLN . 23.9 Cg_exo -63.06 134.19 44.82 Favored 'Trans proline' 0 C--N 1.351 0.698 0 C-N-CA 122.798 2.332 . . . . 0.0 112.501 -174.4 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.449 ' H ' ' HB2' ' A' ' 100' ' ' SER . 52.7 p -90.87 168.84 11.41 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.434 176.454 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 34.9 tp -55.54 -47.1 76.85 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 120.972 0.415 . . . . 0.0 111.151 -177.538 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' HIS . . . . . 0.445 ' HB3' ' HB2' ' A' ' 102' ' ' ASP . 45.9 m-70 -108.67 36.98 2.65 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.818 0.342 . . . . 0.0 110.492 178.558 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 100' ' ' SER . . . . . 0.449 ' HB2' ' H ' ' A' ' 97' ' ' THR . 15.6 t -59.22 -48.98 79.61 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.064 0.459 . . . . 0.0 110.511 178.341 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.476 ' O ' ' HG3' ' A' ' 105' ' ' GLN . 84.3 m-85 -80.21 -1.52 40.91 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.591 -177.934 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' ASP . . . . . 0.445 ' HB2' ' HB3' ' A' ' 99' ' ' HIS . 16.1 t70 -52.88 -42.71 65.54 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 120.993 0.425 . . . . 0.0 110.608 -176.875 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.58 ' O ' ' HG2' ' A' ' 107' ' ' ARG . . . -57.22 -51.31 69.85 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.464 176.699 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.69 -40.18 87.02 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.979 -179.314 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.476 ' HG3' ' O ' ' A' ' 101' ' ' PHE . 25.9 mt-30 -60.63 -43.86 97.04 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.921 178.645 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 25.8 t -62.23 -37.43 85.38 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.605 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' ARG . . . . . 0.58 ' HG2' ' O ' ' A' ' 103' ' ' ALA . 16.3 mmm180 -65.42 -60.53 2.86 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.051 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 53.7 t -53.46 -40.66 41.82 Favored 'Isoleucine or valine' 0 C--O 1.239 0.54 0 CA-C-O 121.39 0.614 . . . . 0.0 110.865 178.965 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' TYR . . . . . 0.544 ' HA ' ' HE3' ' A' ' 112' ' ' MET . 30.4 t80 -60.68 -51.89 67.44 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.312 -179.88 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 110' ' ' GLN . . . . . 0.524 ' HG3' ' O ' ' A' ' 107' ' ' ARG . 0.0 OUTLIER -61.81 -28.83 69.75 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 120.485 0.183 . . . . 0.0 110.509 -175.189 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.478 HD13 ' O ' ' A' ' 107' ' ' ARG . 10.1 mp -60.56 -68.1 0.33 Allowed 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.316 175.179 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 112' ' ' MET . . . . . 0.544 ' HE3' ' HA ' ' A' ' 109' ' ' TYR . 0.0 OUTLIER -68.97 -12.46 61.69 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.475 -175.171 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 113' ' ' GLU . . . . . 0.558 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 44.5 tt0 -64.43 -63.8 1.04 Allowed 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 172.637 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 29.8 pt20 -68.62 -20.69 64.5 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.463 -175.905 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -95.3 -63.09 1.2 Allowed 'General case' 0 C--O 1.233 0.214 0 CA-C-O 120.748 0.308 . . . . 0.0 111.588 -179.289 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 23.8 m -86.22 -37.23 18.87 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 112.709 0.633 . . . . 0.0 112.709 -170.642 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' TYR . . . . . 0.558 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 31.3 t80 -64.25 -37.44 87.5 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 120.866 -0.333 . . . . 0.0 110.751 -176.036 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 24.5 p -59.45 -46.38 88.92 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 121.533 0.682 . . . . 0.0 109.74 175.15 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 22.4 mmt180 -60.81 -38.49 85.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.48 176.92 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -61.04 -41.12 95.98 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.444 178.695 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 87.6 mt -69.36 -22.63 63.72 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.309 -178.907 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 122' ' ' LYS . . . . . 0.72 ' HE3' ' HA ' ' A' ' 122' ' ' LYS . 0.0 OUTLIER -115.38 15.02 16.86 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.598 0.237 . . . . 0.0 111.602 178.61 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 96.2 p -74.7 145.86 42.76 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 120.939 0.4 . . . . 0.0 111.117 -179.217 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -56.08 -36.59 68.27 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.802 176.735 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.527 ' O ' ' HG ' ' A' ' 129' ' ' LEU . 8.2 tp -66.87 -40.68 86.33 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.553 -179.561 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 84.6 t80 -63.41 -42.88 98.77 Favored 'General case' 0 C--O 1.232 0.175 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 176.837 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 93.3 mt -64.32 -29.4 70.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.222 176.601 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -71.14 -29.67 65.52 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.934 177.159 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.527 ' HG ' ' O ' ' A' ' 125' ' ' ILE . 69.6 mt -75.19 -25.41 58.22 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.136 176.197 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 130' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.533 0.298 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.417 -179.08 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.454 ' CG2' ' HB3' ' A' ' 7' ' ' GLU . 9.1 p . . . . . 0 C--O 1.233 0.193 0 CA-C-O 120.782 0.325 . . . . 0.0 111.326 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 35.4 t -88.15 148.13 42.15 Favored Pre-proline 0 CA--C 1.534 0.344 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.809 177.359 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_exo -45.41 -33.76 9.57 Favored 'Trans proline' 0 C--N 1.357 0.984 0 C-N-CA 123.003 2.468 . . . . 0.0 112.772 178.499 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.441 ' O ' HG22 ' A' ' 9' ' ' VAL . 12.6 mm-40 -53.91 -65.01 0.64 Allowed 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.193 0.52 . . . . 0.0 110.734 177.058 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.454 ' HB3' ' CG2' ' A' ' 3' ' ' VAL . 8.1 tp10 -64.57 -33.21 75.39 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.095 -178.372 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.23 -48.24 82.34 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.496 -179.025 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.553 HG23 ' HD2' ' A' ' 10' ' ' LYS . 31.8 m -69.25 -28.52 39.03 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 C-N-CA 120.914 -0.314 . . . . 0.0 110.571 179.781 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.553 ' HD2' HG23 ' A' ' 9' ' ' VAL . 3.1 mptp? -68.59 -29.57 68.13 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.644 0.259 . . . . 0.0 110.689 175.649 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 50.7 m0 -63.89 -32.41 73.92 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 170.888 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -79.92 0.95 81.29 Favored Glycine 0 C--N 1.331 0.304 0 CA-C-N 115.362 -0.836 . . . . 0.0 113.099 -177.602 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.547 ' HG2' ' HA ' ' A' ' 10' ' ' LYS . 11.2 pt-20 -130.65 0.86 4.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.857 0.36 . . . . 0.0 110.418 177.236 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.1 m -152.46 99.02 2.44 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.494 -179.004 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.405 ' HE2' ' HB2' ' A' ' 117' ' ' TYR . 36.8 t80 -59.48 -36.01 75.2 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.141 0.496 . . . . 0.0 109.765 178.034 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -57.21 -38.31 73.52 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.277 176.734 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.638 ' NZ ' ' HB2' ' A' ' 17' ' ' LYS . 1.0 OUTLIER -75.69 -30.09 59.22 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.245 -0.888 . . . . 0.0 110.184 -173.37 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 65.8 tp -59.85 -47.2 86.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.68 173.334 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 7.5 mp -77.14 -25.37 51.95 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.987 178.782 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 42.8 t -62.45 -29.63 70.66 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.388 178.976 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -95.13 129.8 42.1 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.106 176.142 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.641 HH11 ' HB2' ' A' ' 26' ' ' GLU . 2.1 tmt_? -58.27 -33.46 69.44 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 176.557 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -61.85 -52.71 63.03 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.986 177.225 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -63.36 -37.8 95.41 Favored Glycine 0 C--N 1.334 0.419 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.89 -179.298 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 16.1 tp -54.16 -58.09 8.67 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.096 0.474 . . . . 0.0 110.481 175.626 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.641 ' HB2' HH11 ' A' ' 22' ' ' ARG . 15.6 tp10 -65.65 -40.8 92.86 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.534 -176.272 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.43 ' O ' ' HG3' ' A' ' 30' ' ' ARG . . . -61.14 -45.77 93.28 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-O 121.008 0.433 . . . . 0.0 110.71 179.072 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -70.92 -41.11 71.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.899 -177.49 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.531 HG22 ' HA ' ' A' ' 26' ' ' GLU . 14.9 t -69.93 -42.74 72.87 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 120.816 -0.354 . . . . 0.0 110.701 -177.917 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.472 ' NH1' HD11 ' A' ' 125' ' ' ILE . 0.0 OUTLIER -63.58 -27.32 69.17 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.037 0.446 . . . . 0.0 109.811 179.245 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.591 ' O ' HG22 ' A' ' 34' ' ' THR . 93.8 t80 -77.12 -44.3 30.92 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.701 -0.682 . . . . 0.0 109.802 174.068 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.417 HD23 ' HA ' ' A' ' 38' ' ' GLU . 22.9 tp -69.82 -16.63 63.31 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.789 -176.426 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.563 ' HG2' ' HG2' ' A' ' 38' ' ' GLU . 98.2 mttt -81.94 -18.21 44.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.492 179.294 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.591 HG22 ' O ' ' A' ' 31' ' ' PHE . 2.5 t -72.03 -28.48 63.39 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 121.286 0.565 . . . . 0.0 109.613 178.923 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -102.15 -1.64 31.01 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.283 176.72 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 94.5 m-85 52.63 67.66 0.95 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.373 -179.656 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 29.5 t -132.42 12.17 4.54 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.926 177.641 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.563 ' HG2' ' HG2' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -63.78 -18.0 63.64 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.969 179.364 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.424 ' HG3' ' N ' ' A' ' 40' ' ' ASN . 7.5 pt-20 -43.56 -42.5 5.08 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.027 171.775 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.485 ' HB3' HG13 ' A' ' 108' ' ' VAL . 57.1 m-80 -64.02 -46.45 84.42 Favored 'General case' 0 C--O 1.243 0.713 0 CA-C-N 115.329 -0.851 . . . . 0.0 111.404 -175.895 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.449 ' O ' HG13 ' A' ' 45' ' ' ILE . 32.4 mt -60.77 -51.75 69.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.171 179.831 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -64.57 -24.32 67.56 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.293 178.155 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.482 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 84.2 t80 -58.32 -60.98 2.92 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.711 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 6.7 p-90 -75.88 -17.73 59.68 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 119.762 -0.775 . . . . 0.0 111.854 -178.537 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.449 HG13 ' O ' ' A' ' 41' ' ' ILE . 33.6 mt -60.76 -47.04 94.9 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 170.578 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.41 -34.75 79.04 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.634 178.72 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.772 ' SG ' ' HB2' ' A' ' 101' ' ' PHE . 49.8 t -60.95 -41.68 96.78 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.507 178.831 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -71.53 -31.09 66.66 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 121.131 0.491 . . . . 0.0 109.997 179.136 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.773 ' HA ' ' HE2' ' A' ' 52' ' ' LYS . 77.8 m-20 -66.08 -32.12 73.4 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 121.308 0.575 . . . . 0.0 109.748 174.702 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 43.3 t80 -70.0 -35.53 74.44 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.455 176.212 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 6.1 tmtm? -58.9 -35.66 73.41 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.697 175.909 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.773 ' HE2' ' HA ' ' A' ' 49' ' ' ASP . 1.9 mppt? -58.25 -47.7 82.73 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.022 175.481 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.401 ' HB2' ' CG ' ' A' ' 58' ' ' GLN . 6.2 p -74.52 79.66 1.95 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.199 0.523 . . . . 0.0 110.627 -178.451 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.63 11.32 9.11 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 115.438 -0.801 . . . . 0.0 112.525 -176.299 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' GLY . . . . . 0.541 ' O ' HG12 ' A' ' 59' ' ' ILE . . . -69.3 126.61 19.77 Favored Glycine 0 CA--C 1.52 0.383 0 C-N-CA 120.81 -0.709 . . . . 0.0 111.521 177.344 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -52.84 -47.75 25.73 Favored 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 122.734 2.29 . . . . 0.0 113.081 -174.169 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 69.4 mt-30 -75.22 -40.85 58.76 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 178.735 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.557 ' O ' ' HB2' ' A' ' 62' ' ' LYS . 6.7 tp-100 -51.17 -39.19 55.82 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 114.858 -1.065 . . . . 0.0 110.704 178.933 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.541 HG12 ' O ' ' A' ' 55' ' ' GLY . 29.6 mm -50.59 -48.41 26.85 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.596 179.527 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 46.2 m-70 -68.07 -54.23 19.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.994 -173.026 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 3.7 pp -69.42 -25.81 64.31 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.084 -176.704 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.557 ' HB2' ' O ' ' A' ' 58' ' ' GLN . 2.0 tmtm? -70.21 -45.73 66.0 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 175.473 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.51 -32.66 71.67 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.545 177.11 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' LYS . . . . . 0.421 ' O ' ' HB3' ' A' ' 67' ' ' TYR . 16.2 tppt? -58.94 -46.93 86.81 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.952 0.406 . . . . 0.0 110.267 174.921 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.23 -43.77 98.34 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.599 179.067 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 64.0 mt -68.76 -29.46 43.71 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.312 178.072 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.589 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 92.0 t80 -61.65 -63.83 1.14 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.325 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -61.22 -37.07 81.7 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.711 -175.749 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -83.46 -37.91 22.54 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -173.887 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -120.67 -50.14 2.21 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -171.506 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.589 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 49.2 mm -71.67 -31.08 40.68 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 CA-C-O 120.49 0.185 . . . . 0.0 111.36 -169.176 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 12.2 mm-40 -58.15 145.64 36.27 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.168 0.509 . . . . 0.0 111.233 178.513 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 27.7 m -77.47 -45.95 24.05 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 169.756 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -85.49 60.79 6.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.569 172.986 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.581 ' HB3' ' HA ' ' A' ' 78' ' ' GLU . . . -97.76 161.18 26.6 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.315 -178.685 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_exo -49.6 -53.25 7.35 Favored 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 122.798 2.332 . . . . 0.0 112.745 179.216 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.524 ' HD3' ' O ' ' A' ' 77' ' ' LYS . 1.4 tmtp? -108.99 -23.25 11.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.01 -179.126 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.581 ' HA ' ' HB3' ' A' ' 75' ' ' ALA . 36.4 mt-10 70.4 156.38 0.15 Allowed 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.435 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.44 HG12 ' H ' ' A' ' 81' ' ' LEU . 50.7 t -130.5 133.09 64.18 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.643 176.944 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 35.9 m-80 -79.48 20.49 0.55 Allowed 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 122.617 0.367 . . . . 0.0 111.869 -176.326 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.44 ' H ' HG12 ' A' ' 79' ' ' VAL . 14.1 tp -62.93 147.42 50.44 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.899 176.814 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -46.57 126.34 8.17 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.852 178.641 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.547 ' HA ' ' HD3' ' A' ' 86' ' ' LYS . 87.1 t80 -57.02 -39.58 75.04 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.181 -178.368 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 83.2 t60 -66.01 -29.74 70.16 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.714 0.292 . . . . 0.0 110.834 -178.266 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 56.8 m -71.43 -46.66 59.52 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 175.454 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.565 ' O ' HG23 ' A' ' 90' ' ' THR . 26.1 mtpp -55.99 -41.49 74.92 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.584 175.223 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -52.9 -59.72 4.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 114.887 -1.051 . . . . 0.0 111.107 -179.928 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 61.3 t -56.49 -40.71 69.57 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.908 -178.104 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 75.2 mt -66.92 -47.7 81.73 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.19 -178.113 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.565 HG23 ' O ' ' A' ' 86' ' ' LYS . 82.8 p -59.8 -31.27 69.55 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 120.922 0.392 . . . . 0.0 111.117 -176.694 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -85.13 -24.5 27.98 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.99 -179.784 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 32.3 t -97.0 2.14 51.11 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.802 -179.647 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.5 tp -53.3 -29.98 16.79 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.819 -177.156 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 8.8 t -61.85 -38.39 88.06 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.955 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -141.91 81.0 15.0 Favored Pre-proline 0 N--CA 1.464 0.259 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.502 -179.652 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' PRO . . . . . 0.45 ' HG2' HG22 ' A' ' 59' ' ' ILE . 93.2 Cg_endo -86.62 143.33 7.26 Favored 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 122.662 2.241 . . . . 0.0 111.706 176.566 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.448 ' H ' ' HB3' ' A' ' 100' ' ' SER . 36.7 p -79.39 171.55 15.01 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.135 177.559 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 36.2 tp -57.54 -30.63 65.36 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.61 -174.729 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' HIS . . . . . 0.435 ' O ' ' HB2' ' A' ' 102' ' ' ASP . 0.1 OUTLIER -132.63 43.55 2.97 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 177.939 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 100' ' ' SER . . . . . 0.448 ' HB3' ' H ' ' A' ' 97' ' ' THR . 6.3 p -53.12 -33.47 52.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.428 -0.806 . . . . 0.0 112.076 -178.723 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.772 ' HB2' ' SG ' ' A' ' 47' ' ' CYS . 38.7 m-85 -83.2 9.38 10.74 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.223 -176.807 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 102' ' ' ASP . . . . . 0.435 ' HB2' ' O ' ' A' ' 99' ' ' HIS . 19.0 t70 -56.94 -44.75 82.84 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 121.009 0.433 . . . . 0.0 110.966 -176.371 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.01 -31.98 71.58 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.57 178.078 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.425 ' HB3' ' O ' ' A' ' 101' ' ' PHE . . . -66.46 -37.03 84.23 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.498 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.402 ' OE1' ' HA ' ' A' ' 102' ' ' ASP . 1.4 mp0 -54.57 -41.68 70.13 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 120.826 0.346 . . . . 0.0 110.288 176.209 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 49.0 m -62.24 -53.37 56.13 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.592 -179.269 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 39.5 mmt-85 -57.49 -48.97 77.8 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.239 -179.679 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.485 HG13 ' HB3' ' A' ' 40' ' ' ASN . 71.2 t -64.29 -52.52 54.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.863 -176.027 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -56.11 -53.74 53.37 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.462 -176.82 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.1 -31.02 71.21 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.834 -175.043 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 54.4 tp -65.24 -47.97 74.92 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.506 -179.224 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 62.8 mtm -62.33 -39.35 92.78 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.176 0.512 . . . . 0.0 110.146 178.133 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 113' ' ' GLU . . . . . 0.612 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 38.4 tt0 -58.93 -62.5 1.83 Allowed 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.302 -175.848 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -54.4 -31.56 55.24 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 -169.338 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -105.28 -63.21 1.26 Allowed 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 112.085 0.402 . . . . 0.0 112.085 -175.939 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 22.5 t -70.52 -42.3 71.44 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.686 0.279 . . . . 0.0 111.101 -173.52 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 117' ' ' TYR . . . . . 0.612 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 28.3 t80 -67.48 -35.77 79.82 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.725 -0.216 . . . . 0.0 111.321 -175.495 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 29.8 p -65.45 -49.54 68.77 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-O 120.856 0.36 . . . . 0.0 110.366 178.538 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 38.4 ttt180 -62.54 -34.33 76.71 Favored 'General case' 0 C--O 1.225 -0.201 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 176.127 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 83.5 t80 -61.35 -33.85 74.32 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.198 177.223 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 81.5 mt -68.96 -24.74 64.29 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.767 0.317 . . . . 0.0 110.737 177.117 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 17.7 tptt -113.39 15.08 19.24 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 120.963 -0.295 . . . . 0.0 111.576 177.53 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 92.5 p -73.14 157.92 36.29 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.637 0.256 . . . . 0.0 110.53 -179.506 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -55.17 -28.32 52.02 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.041 0.448 . . . . 0.0 110.067 175.362 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.472 HD11 ' NH1' ' A' ' 30' ' ' ARG . 58.9 mt -62.43 -56.75 15.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.452 177.148 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 126' ' ' TYR . . . . . 0.51 ' OH ' ' HA ' ' A' ' 9' ' ' VAL . 32.0 t80 -70.21 -39.37 75.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.555 -175.004 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 98.5 mt -60.72 -32.28 71.55 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 121.099 0.476 . . . . 0.0 110.062 177.022 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -66.82 -36.84 83.29 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.231 177.053 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 72.4 mt -74.25 -29.26 61.6 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.753 177.984 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 130' ' ' MET . . . . . . . . . . . . . 21.3 mmt . . . . . 0 N--CA 1.467 0.417 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.425 -177.853 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 2.6 p . . . . . 0 CA--C 1.53 0.187 0 CA-C-O 121.189 0.519 . . . . 0.0 111.151 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.6 m -119.75 162.37 33.2 Favored Pre-proline 0 CA--C 1.534 0.333 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.39 178.335 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo -41.83 -48.53 5.92 Favored 'Trans proline' 0 C--N 1.356 0.921 0 C-N-CA 123.16 2.574 . . . . 0.0 113.339 -179.802 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.639 ' O ' ' HG2' ' A' ' 10' ' ' LYS . 49.9 mt-10 -62.81 -40.81 98.51 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 120.749 0.309 . . . . 0.0 110.978 179.765 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 15.4 tp10 -63.47 -36.41 83.65 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.185 0.517 . . . . 0.0 109.729 177.765 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.08 -41.0 91.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.263 -179.37 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.578 HG22 ' O ' ' A' ' 6' ' ' GLU . 16.3 m -69.97 -25.11 27.27 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.239 0 C-N-CA 120.797 -0.361 . . . . 0.0 110.42 179.918 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.639 ' HG2' ' O ' ' A' ' 6' ' ' GLU . 74.6 mmtt -64.12 -32.22 73.7 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 121.377 0.608 . . . . 0.0 109.667 175.199 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 31.4 m0 -79.36 -33.49 42.89 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.437 176.594 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -72.38 -0.49 46.71 Favored Glycine 0 C--N 1.334 0.441 0 CA-C-N 115.308 -0.86 . . . . 0.0 112.975 -179.577 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -115.51 -4.66 12.26 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.848 0.324 . . . . 0.0 110.889 176.506 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 43.7 t -165.32 111.05 0.92 Allowed 'General case' 0 C--O 1.234 0.264 0 CA-C-O 120.862 0.363 . . . . 0.0 111.247 -177.707 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 41.4 t80 -63.15 -32.95 74.46 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 174.381 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -58.75 -39.44 80.95 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.034 -0.984 . . . . 0.0 110.588 174.656 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.47 ' HD2' ' O ' ' A' ' 10' ' ' LYS . 38.8 ttmt -76.27 -33.86 59.12 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.402 -179.878 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 53.4 tp -55.76 -46.62 77.84 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 121.203 0.525 . . . . 0.0 110.197 176.16 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.451 HD23 ' CZ2' ' A' ' 44' ' ' TRP . 4.4 mp -76.05 -23.77 55.11 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.851 179.748 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.0 t -70.97 -25.73 62.84 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.927 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -97.8 123.53 41.8 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 69.4 mtp180 -52.66 -39.47 61.87 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 120.738 0.304 . . . . 0.0 110.859 -179.147 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -54.84 -47.25 74.38 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.683 -0.69 . . . . 0.0 109.996 177.613 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -71.21 -40.23 61.49 Favored Glycine 0 N--CA 1.45 -0.367 0 CA-C-N 115.385 -0.825 . . . . 0.0 112.0 -179.119 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.425 ' O ' HG22 ' A' ' 29' ' ' THR . 10.0 tt -58.66 -47.99 82.58 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 178.635 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -57.42 -57.14 13.95 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.333 178.331 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -58.38 -40.81 83.34 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.361 -177.346 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 93.2 t80 -74.31 -40.99 61.87 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.722 -175.572 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.626 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 11.7 t -72.54 -41.12 66.15 Favored 'General case' 0 CA--C 1.515 -0.39 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 -175.893 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 11.0 ttm180 -56.18 -42.16 76.64 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.167 173.433 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.509 ' O ' HG22 ' A' ' 34' ' ' THR . 89.1 t80 -67.46 -28.98 68.32 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.993 179.063 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 32.4 tp -86.58 -27.61 23.8 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 121.062 0.458 . . . . 0.0 110.869 -178.994 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.626 ' HG3' ' O ' ' A' ' 29' ' ' THR . 68.3 mttm -72.57 -17.93 61.66 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.874 179.807 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.509 HG22 ' O ' ' A' ' 31' ' ' PHE . 4.3 t -62.15 -27.25 68.81 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 120.915 0.388 . . . . 0.0 110.471 179.351 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -111.55 5.83 19.7 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.759 179.655 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 63.05 24.49 14.53 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 115.782 -0.645 . . . . 0.0 112.36 176.729 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 28.5 m -97.19 19.23 13.36 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.298 0.57 . . . . 0.0 110.279 177.246 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.537 ' HB3' ' HG2' ' A' ' 33' ' ' LYS . 11.8 pt-20 -62.14 -24.96 67.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.24 -0.891 . . . . 0.0 112.332 -173.604 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.447 ' O ' ' HB2' ' A' ' 43' ' ' PHE . 11.3 mp0 -51.61 -22.3 3.22 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -176.959 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.576 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 47.4 m-80 -71.65 -60.84 2.02 Favored 'General case' 0 C--O 1.242 0.676 0 CA-C-O 121.115 0.483 . . . . 0.0 110.901 -179.738 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.457 ' O ' HG13 ' A' ' 45' ' ' ILE . 8.4 tt -62.69 -41.02 90.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 179.37 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.457 ' OE1' ' HB2' ' A' ' 38' ' ' GLU . 0.9 OUTLIER -64.74 -27.0 68.61 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.068 176.227 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.576 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 77.6 t80 -58.85 -59.03 6.1 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 120.703 0.287 . . . . 0.0 110.536 178.061 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.451 ' CZ2' HD23 ' A' ' 19' ' ' LEU . 28.5 p-90 -74.34 -14.79 60.93 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 119.377 -0.929 . . . . 0.0 111.665 -177.162 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.457 HG13 ' O ' ' A' ' 41' ' ' ILE . 68.2 mt -71.16 -37.3 66.03 Favored 'Isoleucine or valine' 0 C--O 1.238 0.461 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 169.231 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.59 -27.04 68.68 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.961 175.473 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.442 ' SG ' ' HB2' ' A' ' 101' ' ' PHE . 53.1 t -62.44 -29.05 70.23 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.038 175.258 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.509 ' O ' ' HG2' ' A' ' 51' ' ' LYS . 19.1 mt-10 -72.31 -41.0 67.07 Favored 'General case' 0 N--CA 1.458 -0.058 0 N-CA-C 109.784 -0.451 . . . . 0.0 109.784 174.397 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -61.36 -26.38 67.79 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.025 0.44 . . . . 0.0 110.377 174.075 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -73.95 -46.14 45.89 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.984 177.4 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.509 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 64.3 pttt -70.2 -23.1 62.89 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 116.759 -0.2 . . . . 0.0 111.422 -175.459 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.478 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 19.3 ptmt -90.37 7.96 35.95 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -177.367 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 65.9 m -54.54 119.16 4.86 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 120.807 0.337 . . . . 0.0 110.443 178.904 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.14 -19.45 65.6 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.782 -175.673 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -125.4 148.47 16.88 Favored Glycine 0 C--N 1.331 0.304 0 C-N-CA 120.95 -0.643 . . . . 0.0 112.402 -177.231 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -67.93 -32.55 28.55 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.683 2.255 . . . . 0.0 111.987 -179.082 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -71.66 -34.48 69.77 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 177.734 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 56.6 tp60 -58.7 -32.45 69.18 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.123 178.745 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.498 HG22 ' HG2' ' A' ' 96' ' ' PRO . 33.9 mm -55.23 -45.44 77.54 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.496 175.668 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 57.3 m80 -66.19 -40.92 90.76 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.115 -178.997 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 77.6 mt -63.91 -49.99 70.49 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.02 -178.599 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.561 ' HA ' ' HE2' ' A' ' 62' ' ' LYS . 9.0 mmpt? -65.55 -42.98 91.26 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.833 -178.701 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.58 -46.78 86.21 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.804 179.648 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 6.7 tmtt? -63.39 -37.04 85.72 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.238 179.315 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.16 -51.91 65.93 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.561 179.054 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 72.6 mt -62.38 -36.01 72.51 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.193 178.46 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.587 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 74.3 t80 -58.48 -63.89 1.12 Allowed 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.489 178.849 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -54.72 -40.12 68.91 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.984 -174.608 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 56.3 tttm -96.41 -16.64 21.11 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 112.478 0.547 . . . . 0.0 112.478 -168.085 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -135.02 -53.37 0.8 Allowed 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 112.705 0.632 . . . . 0.0 112.705 -174.522 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.587 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 48.5 mm -67.41 -41.69 86.48 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 CA-C-O 120.618 0.247 . . . . 0.0 111.401 -170.047 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 51.2 tp60 -50.69 131.46 25.66 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.509 -178.358 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 20.4 m -54.82 -31.49 59.25 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.808 -174.72 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -114.9 32.52 5.97 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.049 0.452 . . . . 0.0 110.749 -178.951 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.546 ' HB3' ' HA ' ' A' ' 78' ' ' GLU . . . -60.44 158.61 28.53 Favored Pre-proline 0 CA--C 1.537 0.481 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.056 179.108 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.486 ' HD2' ' HB1' ' A' ' 75' ' ' ALA . 2.0 Cg_endo -44.05 -54.31 3.96 Favored 'Trans proline' 0 C--N 1.358 1.031 0 C-N-CA 123.672 2.915 . . . . 0.0 113.458 -175.579 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.411 ' O ' ' HG2' ' A' ' 78' ' ' GLU . 43.2 mtpt -107.16 -19.28 13.65 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 110.313 -0.254 . . . . 0.0 110.313 175.16 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.546 ' HA ' ' HB3' ' A' ' 75' ' ' ALA . 10.0 pt-20 52.89 162.84 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.969 1.308 . . . . 0.0 113.282 -179.855 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 64.5 t -126.87 137.57 57.46 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 CA-C-N 114.856 -1.066 . . . . 0.0 108.835 174.572 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.413 ' HB2' HD21 ' A' ' 111' ' ' LEU . 17.6 m120 -74.63 20.56 0.12 Allowed 'General case' 0 N--CA 1.469 0.513 0 O-C-N 123.272 0.358 . . . . 0.0 111.851 -176.34 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.433 ' O ' ' HE3' ' A' ' 86' ' ' LYS . 61.9 tp -50.07 134.42 21.93 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.487 175.034 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -47.43 140.59 5.6 Favored 'General case' 0 N--CA 1.469 0.475 0 O-C-N 123.475 0.484 . . . . 0.0 111.974 -177.744 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 99.1 m-85 -58.25 -48.27 80.97 Favored 'General case' 0 C--N 1.333 -0.109 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.705 -177.375 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' HIS . . . . . 0.406 ' O ' ' HB3' ' A' ' 87' ' ' GLU . 83.1 t60 -59.89 -37.31 79.02 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.048 -179.478 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 25.8 m -67.88 -49.94 59.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.872 -178.547 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.55 ' O ' HG23 ' A' ' 90' ' ' THR . 17.9 ptpt -72.55 -21.33 61.18 Favored 'General case' 0 C--O 1.227 -0.112 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.451 179.278 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.406 ' HB3' ' O ' ' A' ' 84' ' ' HIS . 14.4 tp10 -57.89 -55.23 37.52 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 173.641 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 59.7 t -52.84 -49.37 47.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.926 176.47 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 68.3 mt -58.27 -44.14 87.49 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.853 -177.822 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.55 HG23 ' O ' ' A' ' 86' ' ' LYS . 64.2 p -61.28 -29.21 69.72 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 120.791 0.329 . . . . 0.0 110.824 -177.618 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 56.5 m-80 -88.51 -37.81 15.46 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.669 179.678 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 61.9 p -100.53 11.45 39.44 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 112.011 0.375 . . . . 0.0 112.011 -174.972 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.3 tp -58.37 -24.58 25.17 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 CA-C-O 120.984 0.421 . . . . 0.0 111.391 -178.457 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 8.8 t -76.45 -15.78 59.83 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.588 -179.199 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 16.3 pt20 -135.41 58.69 27.18 Favored Pre-proline 0 CA--C 1.538 0.496 0 CA-C-O 120.903 0.382 . . . . 0.0 110.979 -177.851 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' PRO . . . . . 0.498 ' HG2' HG22 ' A' ' 59' ' ' ILE . 85.3 Cg_endo -81.62 122.47 4.0 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.656 2.237 . . . . 0.0 112.401 -176.309 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 11.5 m -71.42 161.7 30.62 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.197 177.762 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -51.21 -38.74 54.09 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 122.502 0.321 . . . . 0.0 111.654 -177.611 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 28.7 m-70 -113.21 38.88 2.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.075 0.464 . . . . 0.0 110.884 178.545 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 17.2 p -62.29 -53.07 60.48 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.254 0.55 . . . . 0.0 110.476 177.031 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.442 ' HB2' ' SG ' ' A' ' 47' ' ' CYS . 94.8 m-85 -74.11 -0.98 18.27 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.358 -179.801 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 102' ' ' ASP . . . . . 0.502 ' O ' ' HB3' ' A' ' 105' ' ' GLN . 14.6 t70 -61.71 -33.25 73.69 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.13 0.49 . . . . 0.0 109.966 178.621 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.29 -41.57 96.82 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.896 174.783 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.94 -29.6 69.51 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.198 177.817 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.502 ' HB3' ' O ' ' A' ' 102' ' ' ASP . 21.7 tm0? -56.03 -52.29 64.77 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.922 177.005 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 31.5 t -62.06 -38.47 88.92 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.559 179.813 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 107' ' ' ARG . . . . . 0.416 ' O ' ' HG2' ' A' ' 110' ' ' GLN . 6.2 mmp_? -61.3 -54.43 44.05 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.951 179.315 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 96.8 t -64.56 -36.63 77.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 121.309 0.576 . . . . 0.0 110.369 -179.31 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -55.99 -50.57 70.46 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.737 176.477 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' GLN . . . . . 0.416 ' HG2' ' O ' ' A' ' 107' ' ' ARG . 11.2 pt20 -73.76 -29.21 62.08 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 120.821 0.344 . . . . 0.0 110.551 -179.205 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.44 ' O ' ' HG2' ' A' ' 114' ' ' GLN . 57.0 tp -62.85 -43.52 98.58 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.494 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 58.8 mtm -75.63 -35.44 60.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.052 177.41 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 113' ' ' GLU . . . . . 0.439 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 3.7 tm-20 -52.31 -53.46 44.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.938 -177.811 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 114' ' ' GLN . . . . . 0.44 ' HG2' ' O ' ' A' ' 111' ' ' LEU . 4.3 pt20 -54.29 -17.04 2.52 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 112.732 0.641 . . . . 0.0 112.732 -172.831 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 42.4 m-20 -124.88 -68.16 0.87 Allowed 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.225 0.536 . . . . 0.0 110.795 178.515 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 5.0 m -59.09 -29.7 67.55 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.422 -0.808 . . . . 0.0 112.455 -171.309 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 117' ' ' TYR . . . . . 0.439 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 19.6 t80 -65.87 -59.07 4.22 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 120.55 0.214 . . . . 0.0 110.93 -177.956 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 1.3 p -60.97 -38.35 85.65 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.657 0.265 . . . . 0.0 110.926 179.278 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 78.9 mtp85 -58.15 -42.31 85.62 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.001 0.429 . . . . 0.0 110.01 175.194 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -64.14 -38.99 93.03 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.416 178.045 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 92.8 mt -66.76 -21.62 66.05 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.232 -179.217 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? -108.75 -0.94 19.72 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 120.662 0.268 . . . . 0.0 111.488 179.442 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 80.4 p -66.3 152.69 44.42 Favored 'General case' 0 C--O 1.237 0.407 0 O-C-N 122.256 -0.277 . . . . 0.0 110.519 179.613 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -54.47 -31.88 56.61 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 175.717 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.558 ' O ' ' HG ' ' A' ' 129' ' ' LEU . 72.9 mt -55.66 -59.06 2.96 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.174 0 CA-C-N 115.177 -0.919 . . . . 0.0 110.678 178.518 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 58.4 t80 -59.53 -43.94 93.33 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.021 -174.743 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -66.44 -31.55 72.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.794 179.763 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -71.04 -35.41 71.96 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.015 177.656 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.558 ' HG ' ' O ' ' A' ' 125' ' ' ILE . 47.8 mt -59.88 -40.46 88.77 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.915 178.358 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 130' ' ' MET . . . . . . . . . . . . . 23.5 mmt . . . . . 0 C--O 1.234 0.289 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.835 175.924 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.634 HG11 HD13 ' A' ' 129' ' ' LEU . 2.9 p . . . . . 0 CA--C 1.531 0.25 0 CA-C-O 121.359 0.599 . . . . 0.0 111.792 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.417 ' OG ' ' HD2' ' A' ' 5' ' ' PRO . 47.1 t -100.24 156.58 35.11 Favored Pre-proline 0 C--N 1.326 -0.415 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 170.817 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.417 ' HD2' ' OG ' ' A' ' 4' ' ' SER . 72.3 Cg_exo -42.62 -37.88 5.9 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 122.519 2.146 . . . . 0.0 112.73 176.8 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.564 ' O ' HG22 ' A' ' 9' ' ' VAL . 7.0 mm-40 -67.4 -43.12 82.06 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 121.603 0.716 . . . . 0.0 110.16 176.949 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.518 ' HB3' HG23 ' A' ' 3' ' ' VAL . 14.8 tp10 -67.46 -23.31 65.49 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.379 -0.828 . . . . 0.0 109.973 178.922 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -73.9 -47.22 39.45 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.792 178.644 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.564 HG22 ' O ' ' A' ' 6' ' ' GLU . 19.3 m -63.42 -24.13 35.09 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 C-N-CA 121.091 -0.244 . . . . 0.0 110.527 179.745 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.511 ' O ' ' HD2' ' A' ' 17' ' ' LYS . 32.6 mmtp -51.99 -46.91 65.06 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 121.343 0.592 . . . . 0.0 110.224 172.175 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 33.5 m0 -64.51 -28.22 69.51 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.563 -176.163 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -74.62 -11.04 83.12 Favored Glycine 0 N--CA 1.452 -0.256 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.401 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -80.98 -24.77 37.79 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 120.831 0.348 . . . . 0.0 110.543 179.112 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 45.8 t -172.57 131.88 0.57 Allowed 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.661 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -61.52 -25.5 67.32 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.649 174.877 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -68.65 -35.71 77.62 Favored 'General case' 0 N--CA 1.461 0.114 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.007 176.129 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.511 ' HD2' ' O ' ' A' ' 10' ' ' LYS . 35.6 ttmt -70.25 -36.92 74.78 Favored 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 115.998 -0.546 . . . . 0.0 109.928 179.313 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 48.8 tp -58.43 -45.89 87.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.201 174.929 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.7 mp -74.78 -30.64 61.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.932 -177.311 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 69.7 p -78.35 -27.19 46.95 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 120.945 0.402 . . . . 0.0 110.364 178.787 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 24.0 t-80 -72.75 110.3 6.98 Favored 'General case' 0 C--O 1.221 -0.4 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 176.305 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.18 -53.49 16.67 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 121.2 0.524 . . . . 0.0 111.019 -175.238 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -68.81 -20.66 64.33 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.827 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -78.56 -53.41 4.68 Favored Glycine 0 C--N 1.332 0.329 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.795 -179.461 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.9 tt -51.71 -38.4 54.99 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 123.223 0.609 . . . . 0.0 110.682 174.908 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.634 ' O ' ' HG2' ' A' ' 30' ' ' ARG . 10.5 tp10 -62.35 -53.67 51.65 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.88 176.847 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -55.37 -44.97 76.55 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-O 121.293 0.568 . . . . 0.0 110.932 179.772 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' PHE . . . . . 0.416 ' CE2' HD22 ' A' ' 32' ' ' LEU . 75.3 t80 -64.2 -44.14 92.89 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.872 -179.274 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.604 HG22 ' O ' ' A' ' 26' ' ' GLU . 4.0 t -67.01 -27.79 67.71 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.067 -177.941 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.634 ' HG2' ' O ' ' A' ' 26' ' ' GLU . 35.0 mmt180 -54.95 -52.89 61.6 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 173.305 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.581 ' O ' HG22 ' A' ' 34' ' ' THR . 84.3 t80 -68.21 -45.59 72.94 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.945 -179.141 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.416 HD22 ' CE2' ' A' ' 28' ' ' PHE . 21.5 tp -63.56 -29.85 71.04 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.003 0.43 . . . . 0.0 111.179 -175.344 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.433 ' HE2' ' OG1' ' A' ' 29' ' ' THR . 67.6 mttm -80.75 -9.69 59.78 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.559 179.295 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.581 HG22 ' O ' ' A' ' 31' ' ' PHE . 0.7 OUTLIER -84.13 -28.28 27.56 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 177.955 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -98.41 4.67 48.47 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.716 178.113 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 87.1 m-85 65.16 18.01 11.27 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.811 176.051 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 25.5 m -97.21 15.01 23.97 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 121.045 0.45 . . . . 0.0 110.641 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -56.08 -24.23 38.77 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.338 -179.587 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -45.62 -43.6 12.43 Favored 'General case' 0 C--O 1.225 -0.203 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.628 176.7 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.523 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 2.0 m-20 -57.67 -59.24 5.5 Favored 'General case' 0 C--O 1.245 0.837 0 CA-C-O 121.448 0.642 . . . . 0.0 112.007 -175.288 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.473 ' O ' HG13 ' A' ' 45' ' ' ILE . 13.2 tt -61.64 -42.4 94.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.043 -175.807 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.473 ' HA ' ' HB ' ' A' ' 45' ' ' ILE . 49.3 mt-10 -78.96 -10.01 59.69 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.069 -178.943 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.523 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 72.5 t80 -67.73 -59.28 3.44 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 175.311 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.442 ' HA ' ' SG ' ' A' ' 47' ' ' CYS . 32.1 p-90 -76.06 -19.01 58.97 Favored 'General case' 0 N--CA 1.463 0.215 0 C-N-CA 119.887 -0.725 . . . . 0.0 111.414 -178.861 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.473 ' HB ' ' HA ' ' A' ' 42' ' ' GLU . 54.7 mt -62.92 -39.53 85.43 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 169.901 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.24 -35.64 81.67 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.214 175.408 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.442 ' SG ' ' HA ' ' A' ' 44' ' ' TRP . 67.4 m -63.94 -33.55 75.97 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.32 177.03 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.662 ' O ' ' HG2' ' A' ' 51' ' ' LYS . 9.0 mm-40 -66.72 -52.89 39.29 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 173.4 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -53.31 -26.31 18.22 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.349 0.595 . . . . 0.0 110.325 178.265 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.404 ' HD1' ' HD3' ' A' ' 62' ' ' LYS . 41.8 t80 -74.28 -40.3 62.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.334 177.48 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.662 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 59.9 pttt -66.94 -18.13 65.24 Favored 'General case' 0 N--CA 1.471 0.591 0 O-C-N 121.993 -0.442 . . . . 0.0 110.777 -178.302 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -72.7 -27.3 61.99 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.859 177.901 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 67.1 p -59.73 124.04 18.87 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 121.092 0.472 . . . . 0.0 110.419 -177.374 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.98 -14.23 16.03 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.752 -177.892 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -83.39 119.39 4.88 Favored Glycine 0 N--CA 1.448 -0.505 0 CA-C-N 115.934 -0.576 . . . . 0.0 112.03 -179.082 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_exo -53.15 -33.54 64.68 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.86 2.373 . . . . 0.0 112.014 179.062 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 20.3 mp0 -71.67 -39.66 70.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.614 178.495 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 55.4 tp60 -61.83 -40.55 95.66 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.26 -178.341 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 44.4 mm -49.53 -51.35 15.12 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.248 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.972 -178.853 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 76.7 m80 -64.43 -55.1 23.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.692 -0.686 . . . . 0.0 111.688 -175.858 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.502 HD12 ' N ' ' A' ' 62' ' ' LYS . 4.3 pp -71.22 -30.16 66.01 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.805 -173.277 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.502 ' N ' HD12 ' A' ' 61' ' ' LEU . 57.6 tttp -74.29 -43.4 56.96 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 -179.88 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.33 -36.05 82.41 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.252 176.033 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 6.7 tmtt? -63.18 -36.76 84.71 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 115.659 -0.7 . . . . 0.0 109.971 179.026 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -66.87 -55.42 14.84 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.482 177.585 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 66.9 mt -56.31 -35.68 43.93 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-O 121.365 0.602 . . . . 0.0 110.238 178.431 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 76.2 t80 -56.08 -56.85 15.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.071 -0.968 . . . . 0.0 110.52 178.11 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.486 ' HA ' ' HB2' ' A' ' 72' ' ' GLN . 34.3 mt-10 -77.88 -18.22 56.43 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.543 -174.638 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -82.06 -36.73 27.38 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.132 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -126.47 -51.55 1.5 Allowed 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 112.135 0.421 . . . . 0.0 112.135 -174.757 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 33.7 mm -71.98 -15.51 18.11 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.373 0 CA-C-O 121.063 0.459 . . . . 0.0 111.34 -171.946 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.486 ' HB2' ' HA ' ' A' ' 68' ' ' GLU . 16.5 tm0? -58.71 132.79 54.92 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.477 179.143 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.9 m -55.05 -37.3 66.55 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 112.613 0.597 . . . . 0.0 112.613 -170.83 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -84.02 -67.35 0.8 Allowed 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 110.116 -0.327 . . . . 0.0 110.116 179.109 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.404 ' HB3' ' HA ' ' A' ' 78' ' ' GLU . . . 64.06 156.84 0.12 Allowed Pre-proline 0 CA--C 1.539 0.53 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.682 178.971 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -73.31 -7.29 20.23 Favored 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 122.438 2.092 . . . . 0.0 112.586 -178.616 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.446 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 46.6 tttm -145.28 7.92 1.18 Allowed 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.591 -177.873 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.404 ' HA ' ' HB3' ' A' ' 75' ' ' ALA . 12.3 pt-20 38.4 86.24 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.65 0.78 . . . . 0.0 112.266 -174.596 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.425 HG12 ' H ' ' A' ' 81' ' ' LEU . 54.3 t -56.28 132.91 20.47 Favored 'Isoleucine or valine' 0 C--O 1.232 0.16 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.291 -179.376 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 43.9 m-80 -76.25 14.99 0.63 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 116.232 -0.44 . . . . 0.0 112.178 -173.31 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.425 ' H ' HG12 ' A' ' 79' ' ' VAL . 57.7 tp -62.22 133.81 55.68 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 175.537 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -61.36 167.62 3.15 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-O 121.168 0.509 . . . . 0.0 111.785 -176.356 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 92.9 t80 -69.74 -43.97 71.22 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.162 -177.211 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' HIS . . . . . 0.469 ' O ' HG23 ' A' ' 88' ' ' VAL . 80.6 t60 -58.83 -51.83 68.32 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.446 -174.887 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 43.7 m -63.7 -42.76 97.93 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.519 -176.001 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 8.0 ptpp? -67.31 -33.03 74.42 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 120.586 -0.445 . . . . 0.0 109.984 179.236 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -61.86 -45.53 93.37 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.223 0.535 . . . . 0.0 109.898 177.554 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.469 HG23 ' O ' ' A' ' 84' ' ' HIS . 88.2 t -54.86 -43.14 66.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.976 176.583 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 72.4 mt -65.44 -43.76 94.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.886 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 39.9 p -63.72 -25.05 68.02 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 111.683 0.253 . . . . 0.0 111.683 -176.525 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 60.5 m-80 -90.43 -22.94 21.18 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 120.706 0.289 . . . . 0.0 111.16 177.807 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 29.3 t -100.24 -5.48 27.51 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.714 -0.221 . . . . 0.0 111.348 -177.373 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 9.9 tp -62.68 -23.55 33.05 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 CA-C-N 116.683 -0.235 . . . . 0.0 111.608 -175.819 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 6.8 t -58.6 -49.42 77.52 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-O 120.737 0.304 . . . . 0.0 110.88 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 81.1 mt-30 -139.43 81.53 20.26 Favored Pre-proline 0 C--O 1.235 0.316 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 178.352 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -83.1 162.5 15.52 Favored 'Trans proline' 0 CA--C 1.532 0.414 0 C-N-CA 122.834 2.356 . . . . 0.0 112.939 -176.281 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 77.1 p -90.35 174.78 7.39 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.119 174.887 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 9.2 mp -63.72 -11.86 29.66 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 120.828 0.347 . . . . 0.0 111.507 -178.987 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' HIS . . . . . 0.444 ' O ' ' HB2' ' A' ' 102' ' ' ASP . 0.2 OUTLIER -143.64 37.34 1.33 Allowed 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 -178.386 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 22.9 t -57.28 -22.86 44.53 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.969 -176.959 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.41 ' O ' ' HG3' ' A' ' 105' ' ' GLN . 82.8 m-85 -88.93 15.37 8.62 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.797 0.332 . . . . 0.0 110.616 -179.841 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 102' ' ' ASP . . . . . 0.444 ' HB2' ' O ' ' A' ' 99' ' ' HIS . 20.5 t70 -54.67 -53.12 58.97 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.75 -173.768 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.449 ' O ' ' HG2' ' A' ' 107' ' ' ARG . . . -59.98 -37.51 79.84 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 120.993 0.425 . . . . 0.0 111.002 178.807 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.74 -37.73 85.33 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.012 -178.096 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.41 ' HG3' ' O ' ' A' ' 101' ' ' PHE . 33.7 mt-30 -54.86 -57.02 13.28 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-O 121.286 0.565 . . . . 0.0 109.587 177.932 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 106' ' ' SER . . . . . 0.688 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 20.0 m -55.94 -45.58 78.77 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 114.735 -1.12 . . . . 0.0 110.828 -176.86 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 107' ' ' ARG . . . . . 0.501 ' O ' ' HG ' ' A' ' 111' ' ' LEU . 39.8 mmt180 -54.08 -57.97 9.08 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.974 0.416 . . . . 0.0 111.004 -179.56 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.562 ' HA ' HD12 ' A' ' 111' ' ' LEU . 46.3 t -63.17 -33.45 60.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.566 -178.002 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 109' ' ' TYR . . . . . 0.546 ' HA ' ' HE1' ' A' ' 112' ' ' MET . 48.3 t80 -59.14 -45.33 91.22 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.762 177.655 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 110' ' ' GLN . . . . . 0.688 ' HG3' ' O ' ' A' ' 106' ' ' SER . 29.7 mt-30 -61.07 -40.92 95.52 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.528 0.68 . . . . 0.0 109.684 178.063 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.562 HD12 ' HA ' ' A' ' 108' ' ' VAL . 94.4 mt -58.04 -54.12 50.5 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.538 -1.21 . . . . 0.0 112.432 -172.296 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 112' ' ' MET . . . . . 0.546 ' HE1' ' HA ' ' A' ' 109' ' ' TYR . 0.0 OUTLIER -85.59 -12.38 51.68 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 119.864 -0.734 . . . . 0.0 110.922 -177.654 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 113' ' ' GLU . . . . . 0.676 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 38.4 tt0 -63.71 -66.69 0.51 Allowed 'General case' 0 C--O 1.233 0.231 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 174.074 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -50.91 -32.32 20.32 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.676 -177.436 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 115' ' ' ASP . . . . . 0.565 ' O ' ' HD3' ' A' ' 119' ' ' ARG . 25.1 t70 -97.84 -76.5 0.52 Allowed 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.612 -176.68 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 23.0 t -62.8 -38.18 89.67 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -171.55 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 117' ' ' TYR . . . . . 0.676 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 31.0 t80 -64.98 -38.88 92.42 Favored 'General case' 0 N--CA 1.468 0.454 0 O-C-N 122.287 -0.258 . . . . 0.0 111.157 -176.471 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 27.8 p -67.73 -42.03 82.51 Favored 'General case' 0 C--O 1.24 0.568 0 CA-C-O 121.063 0.459 . . . . 0.0 110.541 179.41 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 119' ' ' ARG . . . . . 0.565 ' HD3' ' O ' ' A' ' 115' ' ' ASP . 10.5 mpt_? -66.54 -34.84 78.79 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.005 176.267 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 86.3 t80 -60.83 -42.27 97.43 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 175.938 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.429 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 91.3 mt -61.87 -27.82 69.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.607 177.424 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 122' ' ' LYS . . . . . 0.456 ' HD3' ' HA ' ' A' ' 122' ' ' LYS . 64.0 mmtt -110.03 18.34 20.14 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 112.379 0.511 . . . . 0.0 112.379 179.262 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 80.2 p -79.77 147.72 31.74 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 171.919 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -55.22 -29.87 58.83 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 121.066 0.46 . . . . 0.0 110.39 176.516 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.451 ' O ' ' HG ' ' A' ' 129' ' ' LEU . 2.1 mp -60.19 -57.72 10.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.482 179.4 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 72.9 t80 -65.52 -39.34 91.71 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.664 -177.486 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.401 HD13 ' HA ' ' A' ' 127' ' ' LEU . 3.8 mm? -63.77 -33.41 75.59 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.854 178.136 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -67.83 -34.53 76.9 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.065 0.459 . . . . 0.0 110.288 176.971 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.634 HD13 HG11 ' A' ' 3' ' ' VAL . 73.3 mt -76.41 -17.53 59.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.451 178.159 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 130' ' ' MET . . . . . 0.408 ' HE1' HG13 ' A' ' 9' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--N 1.332 -0.172 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.829 178.493 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.464 HG23 ' HB3' ' A' ' 7' ' ' GLU . 4.0 p . . . . . 0 N--CA 1.454 -0.263 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 16.8 m -104.37 150.94 38.99 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 116.245 -0.434 . . . . 0.0 109.938 -179.679 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.414 ' HA ' ' HB3' ' A' ' 8' ' ' ALA . 1.2 Cg_endo -45.95 -31.78 8.7 Favored 'Trans proline' 0 C--N 1.353 0.797 0 C-N-CA 123.325 2.684 . . . . 0.0 112.667 178.98 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.462 ' O ' ' HD3' ' A' ' 10' ' ' LYS . 9.1 tp10 -55.74 -52.52 63.63 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-O 121.343 0.592 . . . . 0.0 110.144 175.649 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.464 ' HB3' HG23 ' A' ' 3' ' ' VAL . 9.5 tp10 -69.23 -32.67 72.07 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.727 -0.669 . . . . 0.0 109.967 179.04 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.414 ' HB3' ' HA ' ' A' ' 5' ' ' PRO . . . -62.66 -46.64 87.27 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.073 -179.348 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.424 HG22 ' O ' ' A' ' 6' ' ' GLU . 32.2 m -67.83 -27.93 39.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.313 0 CA-C-O 120.824 0.345 . . . . 0.0 110.198 179.167 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.462 ' HD3' ' O ' ' A' ' 6' ' ' GLU . 13.9 mptt -69.25 -36.52 77.25 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.027 173.244 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.406 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 49.7 m0 -60.83 -36.82 80.08 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 172.05 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -70.58 2.26 16.99 Favored Glycine 0 CA--C 1.521 0.418 0 CA-C-N 114.91 -1.041 . . . . 0.0 113.711 -177.063 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.407 ' HG3' ' O ' ' A' ' 10' ' ' LYS . 2.8 pp20? -127.74 -3.09 5.96 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 117.394 0.597 . . . . 0.0 111.499 177.326 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 74.0 m -153.34 105.78 2.89 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 120.667 0.27 . . . . 0.0 111.005 177.781 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.42 ' O ' ' HB3' ' A' ' 18' ' ' LEU . 30.9 t80 -58.33 -36.77 73.9 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 121.031 0.443 . . . . 0.0 109.932 178.292 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -57.43 -45.41 84.7 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.03 176.48 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.413 ' HB2' ' HE3' ' A' ' 17' ' ' LYS . 37.5 ttmt -65.07 -36.47 84.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.975 -178.513 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.42 ' HB3' ' O ' ' A' ' 15' ' ' PHE . 36.0 tp -59.73 -51.49 69.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.671 175.305 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 21.4 tp -80.49 -24.05 39.72 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.786 -171.704 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 70.7 m -69.57 -27.02 64.77 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.072 0.463 . . . . 0.0 110.629 178.11 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -80.15 129.73 34.71 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.568 174.067 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 10.6 tpt180 -59.47 -32.99 70.76 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 174.4 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -57.57 -50.82 71.85 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.536 176.655 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -70.78 -41.3 63.62 Favored Glycine 0 N--CA 1.449 -0.46 0 CA-C-N 115.014 -0.993 . . . . 0.0 112.217 -177.595 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 9.6 tt -60.21 -47.34 86.38 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 122.783 0.433 . . . . 0.0 110.226 179.572 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.61 ' O ' ' HG2' ' A' ' 30' ' ' ARG . 9.3 tp10 -65.09 -49.35 70.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.827 -179.339 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -59.74 -42.11 92.42 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.071 -179.646 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 76.9 t80 -68.64 -48.38 64.19 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.059 -176.449 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.422 HG22 ' O ' ' A' ' 26' ' ' GLU . 14.6 t -60.53 -36.01 77.36 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 120.695 0.283 . . . . 0.0 110.544 -177.403 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.61 ' HG2' ' O ' ' A' ' 26' ' ' GLU . 21.6 mmt180 -62.53 -52.8 62.01 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.025 0.441 . . . . 0.0 110.326 178.735 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.571 ' O ' HG22 ' A' ' 34' ' ' THR . 84.5 t80 -65.31 -31.03 71.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.609 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 17.7 tp -74.03 -26.77 60.61 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.435 -179.199 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.412 ' HG3' ' O ' ' A' ' 29' ' ' THR . 67.3 mttm -76.95 -34.77 57.59 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.26 178.839 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.571 HG22 ' O ' ' A' ' 31' ' ' PHE . 7.2 t -71.17 -8.52 54.05 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.785 0.326 . . . . 0.0 111.095 -177.013 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -119.24 17.34 13.13 Favored 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 173.142 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 33.4 p90 43.41 29.94 0.28 Allowed 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.171 0.988 . . . . 0.0 112.822 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 31.5 m -95.63 8.88 42.13 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.184 176.375 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -56.8 -21.06 25.93 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.066 -179.205 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.435 ' HG3' ' N ' ' A' ' 40' ' ' ASN . 8.9 pt-20 -49.62 -37.24 27.21 Favored 'General case' 0 C--O 1.225 -0.216 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.271 177.628 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.435 ' N ' ' HG3' ' A' ' 39' ' ' GLU . 46.9 m-80 -60.77 -61.31 2.68 Favored 'General case' 0 C--O 1.24 0.605 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.803 -174.215 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 13.0 tt -64.47 -34.02 66.75 Favored 'Isoleucine or valine' 0 C--O 1.235 0.309 0 CA-C-O 121.053 0.454 . . . . 0.0 110.019 -177.802 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.454 ' O ' HG22 ' A' ' 45' ' ' ILE . 6.3 tp10 -72.74 -25.94 61.39 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.166 -179.309 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.435 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 71.9 t80 -64.63 -65.1 0.72 Allowed 'General case' 0 C--O 1.236 0.384 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.713 179.136 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 32.6 p-90 -78.08 -9.72 59.28 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 119.747 -0.781 . . . . 0.0 112.385 -173.364 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.614 ' O ' ' HG3' ' A' ' 48' ' ' GLU . 9.5 tt -75.17 -31.54 24.76 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.201 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 169.502 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.28 -29.31 69.51 Favored 'General case' 0 C--O 1.232 0.137 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 172.472 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.575 ' SG ' ' HB2' ' A' ' 101' ' ' PHE . 52.7 t -66.22 -32.73 74.33 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.349 176.309 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.614 ' HG3' ' O ' ' A' ' 45' ' ' ILE . 0.0 OUTLIER -82.91 -28.79 29.69 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 177.379 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.441 ' O ' ' HB2' ' A' ' 52' ' ' LYS . 15.6 t70 -58.41 -27.61 64.45 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.742 0.782 . . . . 0.0 109.094 167.386 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.502 ' HB3' ' O ' ' A' ' 47' ' ' CYS . 42.4 t80 -79.3 -30.11 42.75 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 114.87 -1.059 . . . . 0.0 111.211 175.416 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.606 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 10.0 ptmt -60.74 -22.79 64.38 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 174.792 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.441 ' HB2' ' O ' ' A' ' 49' ' ' ASP . 14.0 mptt -72.47 56.79 0.37 Allowed 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.311 168.661 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.405 ' HB2' ' HD3' ' A' ' 62' ' ' LYS . 48.1 t -141.7 94.04 2.63 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.939 0.4 . . . . 0.0 109.939 175.159 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.63 -6.88 59.56 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.836 -179.757 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -106.8 123.19 7.24 Favored Glycine 0 CA--C 1.519 0.302 0 CA-C-O 119.735 -0.48 . . . . 0.0 111.916 -179.597 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_exo -56.39 -26.56 63.28 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.721 2.28 . . . . 0.0 112.507 179.714 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 30.5 mm-40 -71.49 -45.46 62.45 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 174.458 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 75.3 mm-40 -59.23 -31.75 69.35 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.06 179.342 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.4 HG23 ' HZ ' ' A' ' 50' ' ' PHE . 37.2 mm -50.9 -54.43 10.26 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.115 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.614 176.099 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 56.2 m80 -65.86 -36.5 83.62 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.84 -177.67 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 83.4 mt -68.73 -51.77 37.8 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.458 -176.459 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.405 ' HD3' ' HB2' ' A' ' 53' ' ' SER . 52.2 mtpt -71.39 -31.45 67.3 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.413 -177.65 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.72 -42.01 87.01 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 120.968 0.413 . . . . 0.0 110.06 174.415 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 22.5 tptp -59.52 -35.2 73.72 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.097 176.431 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -65.03 -57.2 9.27 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.584 176.849 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 65.3 mt -58.64 -33.33 48.43 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 CA-C-O 121.204 0.526 . . . . 0.0 110.337 179.209 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.538 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 50.5 t80 -55.86 -61.9 2.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.449 177.426 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -71.25 -31.27 67.33 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.728 -174.732 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -82.79 -25.4 32.79 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.755 -174.491 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 85.7 m-85 -133.56 -53.74 0.88 Allowed 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -174.608 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.538 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 50.0 mm -70.72 -29.54 38.39 Favored 'Isoleucine or valine' 0 C--O 1.238 0.492 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 -170.471 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -64.63 143.29 58.03 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.018 -173.703 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.8 m -63.19 -39.56 95.0 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.06 178.263 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -101.24 92.51 5.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.538 0.685 . . . . 0.0 109.708 172.9 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.503 ' HB3' ' HA ' ' A' ' 78' ' ' GLU . . . -123.27 161.33 45.82 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.2 -176.312 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.502 ' HD2' ' HB1' ' A' ' 75' ' ' ALA . 4.1 Cg_endo -45.63 -37.37 15.49 Favored 'Trans proline' 0 C--N 1.356 0.958 0 C-N-CA 123.451 2.767 . . . . 0.0 113.02 -178.143 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.41 ' HE2' ' HB3' ' A' ' 39' ' ' GLU . 8.7 ttpp -139.93 -3.43 1.43 Allowed 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.615 -0.266 . . . . 0.0 111.081 176.6 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.503 ' HA ' ' HB3' ' A' ' 75' ' ' ALA . 54.8 mt-10 60.94 157.27 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 121.457 0.646 . . . . 0.0 111.92 -176.138 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 68.0 t -119.94 144.84 27.34 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.494 175.792 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -81.59 19.93 0.97 Allowed 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 111.981 0.363 . . . . 0.0 111.981 -176.109 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 28.0 tp -65.77 140.39 58.42 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 175.973 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.408 ' OD2' ' HB3' ' A' ' 84' ' ' HIS . 8.4 p-10 -64.29 156.66 28.26 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.139 0.495 . . . . 0.0 112.098 -171.749 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.422 ' HA ' ' HG2' ' A' ' 86' ' ' LYS . 96.8 m-85 -60.07 -40.43 89.47 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.059 -178.514 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' HIS . . . . . 0.467 ' O ' HG23 ' A' ' 88' ' ' VAL . 24.0 t60 -53.61 -56.3 18.34 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.314 -179.175 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.438 ' OG1' ' HG3' ' A' ' 107' ' ' ARG . 29.2 m -72.06 -42.41 66.27 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.856 -174.588 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.422 ' HG2' ' HA ' ' A' ' 83' ' ' PHE . 0.1 OUTLIER -65.76 -31.85 73.07 Favored 'General case' 0 N--CA 1.463 0.181 0 C-N-CA 120.753 -0.379 . . . . 0.0 110.203 -178.985 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -62.54 -47.93 81.73 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.328 0.585 . . . . 0.0 109.947 177.242 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.467 HG23 ' O ' ' A' ' 84' ' ' HIS . 98.1 t -53.7 -46.3 61.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.554 178.687 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 56.9 mt -72.42 -40.9 64.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.535 -176.566 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 22.0 p -62.87 -21.67 66.14 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.788 0.327 . . . . 0.0 111.25 -178.372 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 35.4 m-80 -96.46 -38.6 9.95 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.094 176.146 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 16.8 t -83.35 0.06 47.6 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.596 -0.274 . . . . 0.0 111.468 -175.896 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 8.0 tp -57.38 -26.59 26.59 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 CA-C-O 120.866 0.365 . . . . 0.0 111.628 -178.843 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.422 HG23 ' HG2' ' A' ' 95' ' ' GLN . 9.9 t -66.45 -28.2 68.42 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 120.978 0.418 . . . . 0.0 110.984 179.313 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.422 ' HG2' HG23 ' A' ' 94' ' ' THR . 22.7 pt20 -139.21 71.45 40.01 Favored Pre-proline 0 CA--C 1.534 0.355 0 CA-C-O 121.129 0.49 . . . . 0.0 110.548 -178.736 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -87.6 131.78 2.91 Favored 'Trans proline' 0 N--CA 1.459 -0.523 0 C-N-CA 122.735 2.29 . . . . 0.0 112.477 -178.886 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.471 ' N ' ' HB2' ' A' ' 100' ' ' SER . 37.9 p -83.52 171.77 13.04 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.411 174.59 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 36.9 tp -61.02 -26.03 67.32 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 121.266 0.555 . . . . 0.0 110.526 -178.791 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' HIS . . . . . 0.568 ' HB3' ' HB2' ' A' ' 102' ' ' ASP . 23.3 m-70 -119.74 34.37 5.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.522 177.171 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 100' ' ' SER . . . . . 0.471 ' HB2' ' N ' ' A' ' 97' ' ' THR . 22.2 t -61.74 -31.81 72.01 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.32 177.337 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.575 ' HB2' ' SG ' ' A' ' 47' ' ' CYS . 88.0 m-85 -91.9 6.36 46.5 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.966 -178.77 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 102' ' ' ASP . . . . . 0.568 ' HB2' ' HB3' ' A' ' 99' ' ' HIS . 12.8 t70 -64.11 -41.65 97.17 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.117 0.484 . . . . 0.0 110.347 -177.178 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.445 ' O ' ' HG2' ' A' ' 107' ' ' ARG . . . -59.32 -43.3 92.68 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.179 176.254 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.0 -37.41 85.84 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.413 177.778 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 21.5 tm0? -57.86 -45.38 86.4 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.169 176.922 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' SER . . . . . 0.674 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 47.7 t -60.15 -58.44 8.53 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.527 -0.761 . . . . 0.0 110.165 176.962 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 107' ' ' ARG . . . . . 0.446 ' O ' ' HG ' ' A' ' 111' ' ' LEU . 23.2 mmm180 -49.22 -55.42 12.62 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 120.945 0.402 . . . . 0.0 111.336 -177.864 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 74.6 t -57.44 -40.03 72.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.026 179.444 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 109' ' ' TYR . . . . . 0.514 ' HA ' ' HE2' ' A' ' 112' ' ' MET . 55.6 t80 -64.26 -37.35 87.16 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.772 178.714 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 110' ' ' GLN . . . . . 0.674 ' HG3' ' O ' ' A' ' 106' ' ' SER . 42.7 mt-30 -67.56 -42.1 83.15 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 178.24 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 107' ' ' ARG . 93.4 mt -59.71 -45.02 93.42 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.819 -1.082 . . . . 0.0 110.679 -179.171 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 112' ' ' MET . . . . . 0.514 ' HE2' ' HA ' ' A' ' 109' ' ' TYR . 54.5 mtm -62.08 -41.34 98.07 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 176.811 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 113' ' ' GLU . . . . . 0.634 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 4.5 tm-20 -61.92 -71.03 0.16 Allowed 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.913 -176.169 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -57.69 -18.13 19.01 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -171.487 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 115' ' ' ASP . . . . . 0.468 ' O ' ' HD3' ' A' ' 119' ' ' ARG . 7.8 m-20 -118.26 -75.99 0.58 Allowed 'General case' 0 N--CA 1.463 0.201 0 N-CA-C 111.576 0.213 . . . . 0.0 111.576 179.075 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 17.6 m -58.56 -28.37 65.46 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -171.641 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 117' ' ' TYR . . . . . 0.634 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 68.4 t80 -78.11 -45.32 23.71 Favored 'General case' 0 C--N 1.333 -0.123 0 N-CA-C 110.694 -0.113 . . . . 0.0 110.694 -176.825 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 118' ' ' THR . . . . . 0.55 HG23 ' HD2' ' A' ' 119' ' ' ARG . 11.5 t -66.62 -40.22 88.68 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-O 120.918 0.389 . . . . 0.0 110.151 178.294 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 119' ' ' ARG . . . . . 0.55 ' HD2' HG23 ' A' ' 118' ' ' THR . 3.1 mpt_? -61.53 -38.66 88.22 Favored 'General case' 0 N--CA 1.461 0.104 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 173.754 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 120' ' ' PHE . . . . . 0.48 ' HA ' ' HB3' ' A' ' 123' ' ' SER . 76.8 t80 -64.7 -36.16 83.39 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.322 177.38 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 89.9 mt -59.76 -28.99 67.87 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.646 0.26 . . . . 0.0 110.576 178.035 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 122' ' ' LYS . . . . . 0.451 ' HD3' ' HA ' ' A' ' 122' ' ' LYS . 31.1 mmtp -115.1 16.9 16.97 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 176.121 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 123' ' ' SER . . . . . 0.48 ' HB3' ' HA ' ' A' ' 120' ' ' PHE . 83.6 p -70.42 141.48 52.12 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 173.408 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -55.88 -38.14 69.75 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.243 -178.841 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.476 ' O ' ' HG ' ' A' ' 129' ' ' LEU . 7.7 tp -65.09 -42.86 95.54 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.147 -179.318 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 73.6 t80 -69.62 -36.97 76.64 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.743 0.306 . . . . 0.0 110.684 -179.609 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 94.4 mt -66.39 -29.88 70.14 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 120.934 0.397 . . . . 0.0 110.019 177.3 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -65.53 -34.05 77.35 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.048 173.913 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.476 ' HG ' ' O ' ' A' ' 125' ' ' ILE . 55.2 mt -76.3 -29.95 57.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.592 177.325 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 130' ' ' MET . . . . . . . . . . . . . 4.7 mmt . . . . . 0 N--CA 1.47 0.533 0 CA-C-N 116.094 -0.503 . . . . 0.0 112.128 -179.451 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.451 HG11 ' CH2' ' A' ' 11' ' ' TRP . 8.6 p . . . . . 0 C--O 1.233 0.219 0 CA-C-O 120.968 0.413 . . . . 0.0 111.494 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.408 ' N ' HG22 ' A' ' 3' ' ' VAL . 36.9 m -66.06 132.06 94.56 Favored Pre-proline 0 CA--C 1.534 0.363 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.889 172.602 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_exo -49.14 -33.98 29.06 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 123.159 2.573 . . . . 0.0 113.433 -176.012 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.509 ' O ' ' HG2' ' A' ' 10' ' ' LYS . 42.1 mt-10 -61.76 -45.61 93.17 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-O 120.809 0.337 . . . . 0.0 110.803 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.407 ' O ' ' HB2' ' A' ' 10' ' ' LYS . 17.4 tp10 -70.22 -33.38 71.6 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.155 0.502 . . . . 0.0 109.7 177.814 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.21 -45.5 92.98 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.804 179.124 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 30.7 m -75.02 -19.06 16.28 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-O 120.758 0.313 . . . . 0.0 110.837 179.486 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.509 ' HG2' ' O ' ' A' ' 6' ' ' GLU . 72.0 mmtt -67.06 -29.1 68.79 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.513 173.274 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.451 ' CH2' HG11 ' A' ' 3' ' ' VAL . 54.2 m0 -62.08 -24.11 66.91 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.074 -179.28 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -65.59 -12.07 55.26 Favored Glycine 0 CA--C 1.521 0.424 0 C-N-CA 121.173 -0.537 . . . . 0.0 112.593 177.325 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -74.71 -49.67 20.31 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 120.718 0.294 . . . . 0.0 110.611 177.866 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 30.5 m -154.19 128.76 9.26 Favored 'General case' 0 C--O 1.24 0.575 0 CA-C-O 121.024 0.44 . . . . 0.0 111.639 -175.127 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.454 ' CD1' HD23 ' A' ' 18' ' ' LEU . 84.8 t80 -55.55 -26.84 45.55 Favored 'General case' 0 N--CA 1.461 0.111 0 CA-C-N 115.641 -0.708 . . . . 0.0 109.931 175.141 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -51.89 -55.39 20.43 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.377 -0.828 . . . . 0.0 111.168 177.243 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.485 ' HD2' ' O ' ' A' ' 10' ' ' LYS . 17.3 ptpt -71.94 -30.42 65.3 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 120.927 -0.309 . . . . 0.0 110.363 -176.616 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.454 HD23 ' CD1' ' A' ' 15' ' ' PHE . 51.6 tp -56.32 -51.93 66.43 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.068 -0.514 . . . . 0.0 109.98 175.052 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 51.4 tp -71.19 -35.26 71.51 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.86 -178.138 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.0 m -74.3 -22.26 59.36 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.878 -177.103 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.9 t-80 -90.61 117.66 29.45 Favored 'General case' 0 N--CA 1.462 0.134 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 -179.641 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.539 ' HD3' ' H ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -36.68 -53.46 0.9 Allowed 'General case' 0 N--CA 1.475 0.817 0 O-C-N 123.847 0.717 . . . . 0.0 111.852 -176.682 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -56.93 -45.36 82.8 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.77 -177.454 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -65.95 -44.64 91.31 Favored Glycine 0 C--N 1.333 0.372 0 CA-C-N 115.727 -0.669 . . . . 0.0 111.791 -179.198 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 8.0 tt -57.9 -44.84 87.03 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.888 0.375 . . . . 0.0 110.299 177.991 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -64.33 -46.43 83.54 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.555 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -63.76 -35.41 80.49 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 120.999 0.428 . . . . 0.0 110.504 179.597 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -71.0 -49.51 44.45 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.419 -0.809 . . . . 0.0 110.956 -176.393 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 9.1 t -62.86 -36.12 82.24 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 120.656 0.265 . . . . 0.0 110.704 -178.552 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 74.6 mtm180 -64.92 -38.94 92.63 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 120.731 0.3 . . . . 0.0 111.104 179.661 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.583 ' O ' HG22 ' A' ' 34' ' ' THR . 87.0 t80 -76.55 -50.69 13.3 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.055 0.455 . . . . 0.0 110.553 178.789 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 36.8 tp -58.36 -24.95 61.37 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.011 -178.495 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 24.0 ttmm -63.75 -33.22 75.16 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.599 -178.665 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.583 HG22 ' O ' ' A' ' 31' ' ' PHE . 6.2 t -68.82 -20.51 64.31 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 121.183 -0.207 . . . . 0.0 111.457 -174.966 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -105.03 -1.5 25.61 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.806 0.336 . . . . 0.0 110.463 177.755 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 61.62 18.99 10.05 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 115.734 -0.666 . . . . 0.0 112.306 175.775 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.3 m -84.05 2.92 36.9 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 121.077 0.465 . . . . 0.0 109.955 176.157 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -51.65 -21.99 3.07 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.252 -0.886 . . . . 0.0 112.709 -177.46 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -58.61 -17.27 20.69 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -176.663 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.461 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 20.7 p30 -67.78 -39.44 84.08 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 121.269 0.557 . . . . 0.0 110.044 175.329 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.461 ' HA ' ' CZ2' ' A' ' 44' ' ' TRP . 58.6 mt -65.53 -47.34 86.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.68 175.406 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.538 ' HA ' HG22 ' A' ' 45' ' ' ILE . 2.8 mp0 -64.51 -24.0 67.46 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.931 176.239 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.461 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 60.3 t80 -61.58 -62.91 1.48 Allowed 'General case' 0 C--O 1.237 0.445 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.464 179.728 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.461 ' CZ2' ' HA ' ' A' ' 41' ' ' ILE . 3.6 p-90 -82.78 -7.81 59.63 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 120.292 -0.563 . . . . 0.0 112.422 -177.678 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.538 HG22 ' HA ' ' A' ' 42' ' ' GLU . 5.5 tt -76.9 -30.37 18.2 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 171.377 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.25 -35.5 71.43 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.735 173.901 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.415 ' O ' ' HB3' ' A' ' 50' ' ' PHE . 71.3 m -63.88 -33.74 76.38 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.12 174.524 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.614 ' O ' ' HG3' ' A' ' 52' ' ' LYS . 3.5 tm-20 -63.59 -51.24 66.19 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 108.434 -0.951 . . . . 0.0 108.434 173.109 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.553 ' HA ' ' CD ' ' A' ' 52' ' ' LYS . 27.5 t70 -50.36 -31.98 16.12 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.601 176.447 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.415 ' HB3' ' O ' ' A' ' 47' ' ' CYS . 78.9 t80 -70.51 -43.82 68.87 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.548 -178.578 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.575 ' HE3' ' HG2' ' A' ' 48' ' ' GLU . 18.6 pttp -69.13 -16.58 63.69 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 120.89 0.376 . . . . 0.0 110.823 -177.502 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.614 ' HG3' ' O ' ' A' ' 48' ' ' GLU . 15.8 mtpp -75.78 -14.02 60.3 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.256 178.739 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 79.4 p -58.22 -47.83 82.27 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.254 -175.669 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 46.91 18.57 0.07 Allowed 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.285 1.034 . . . . 0.0 112.769 -179.413 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' GLY . . . . . 0.469 ' O ' HG12 ' A' ' 59' ' ' ILE . . . -129.89 123.34 4.02 Favored Glycine 0 C--N 1.331 0.251 0 N-CA-C 111.313 -0.715 . . . . 0.0 111.313 -179.121 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.402 ' O ' ' HB ' ' A' ' 59' ' ' ILE . 9.8 Cg_endo -48.9 -52.16 9.18 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 123.378 2.719 . . . . 0.0 112.851 -173.758 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 27.2 pt20 -63.17 -39.46 94.71 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 120.717 0.294 . . . . 0.0 111.085 -179.214 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -68.47 -26.51 65.52 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.395 -178.317 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.469 HG12 ' O ' ' A' ' 55' ' ' GLY . 38.4 mm -55.91 -49.81 72.78 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.213 0 CA-C-O 121.07 0.462 . . . . 0.0 110.169 175.36 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 63.4 m-70 -64.92 -35.29 80.69 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.375 -177.409 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 93.8 mt -73.13 -54.32 8.79 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.518 -176.364 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 32.4 mmtp -63.74 -35.67 81.36 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.539 0.209 . . . . 0.0 110.785 -179.459 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.47 -48.82 80.1 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.189 176.499 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 17.9 tppt? -57.26 -40.42 77.66 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.611 177.266 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.53 -64.05 1.08 Allowed 'General case' 0 C--O 1.234 0.238 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.795 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 64.7 mt -56.39 -36.82 48.32 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 CA-C-O 121.14 0.495 . . . . 0.0 110.542 -179.463 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.481 ' CE1' HG22 ' A' ' 90' ' ' THR . 8.3 t80 -54.55 -73.94 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.348 -179.791 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.405 ' HG3' ' CD2' ' A' ' 67' ' ' TYR . 52.7 mt-10 -75.68 -3.55 35.28 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 -172.686 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.5 tppt? -95.18 -34.89 12.08 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 120.981 -0.288 . . . . 0.0 110.677 177.654 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 72.8 m-85 -130.93 -52.74 1.05 Allowed 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -173.723 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.464 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 46.4 mm -61.0 -44.19 97.69 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 CA-C-O 121.146 0.498 . . . . 0.0 111.388 -171.883 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -69.12 135.35 50.59 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.606 -175.032 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 22.1 m -70.11 -31.88 69.64 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.541 0.686 . . . . 0.0 109.353 176.631 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -83.74 13.26 4.9 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.151 -0.931 . . . . 0.0 110.816 176.859 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.559 ' HB1' ' HD2' ' A' ' 76' ' ' PRO . . . -63.76 160.21 47.13 Favored Pre-proline 0 CA--C 1.532 0.286 0 CA-C-N 116.394 -0.367 . . . . 0.0 110.133 176.118 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' PRO . . . . . 0.559 ' HD2' ' HB1' ' A' ' 75' ' ' ALA . 8.7 Cg_endo -50.27 -30.07 25.09 Favored 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 123.005 2.47 . . . . 0.0 113.164 -174.935 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.508 ' HD2' ' O ' ' A' ' 78' ' ' GLU . 0.1 OUTLIER -146.1 8.47 1.08 Allowed 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 120.639 0.257 . . . . 0.0 111.155 177.781 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.556 ' HA ' ' HB3' ' A' ' 75' ' ' ALA . 9.8 pt-20 45.01 -172.98 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 124.715 1.206 . . . . 0.0 114.022 -179.871 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 54.3 t -153.99 139.54 11.02 Favored 'Isoleucine or valine' 0 C--O 1.237 0.408 0 CA-C-N 114.812 -1.086 . . . . 0.0 108.173 178.203 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 -70.39 88.04 0.64 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.637 0.732 . . . . 0.0 111.082 -179.074 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 14.0 tp -133.91 145.0 49.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 114.751 -1.113 . . . . 0.0 109.175 178.906 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -54.12 142.15 26.47 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 121.299 0.571 . . . . 0.0 112.256 -176.168 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 40.8 p90 -66.5 -43.51 85.13 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.109 -0.95 . . . . 0.0 111.789 -176.909 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' HIS . . . . . 0.421 ' O ' ' HB3' ' A' ' 87' ' ' GLU . 85.2 t60 -70.37 -30.41 67.33 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.109 0.481 . . . . 0.0 110.461 -175.854 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 47.3 m -64.82 -52.15 58.28 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.285 177.666 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.475 ' O ' HG23 ' A' ' 90' ' ' THR . 18.0 ptpt -70.64 -24.04 62.64 Favored 'General case' 0 C--O 1.226 -0.164 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.623 -178.697 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.421 ' HB3' ' O ' ' A' ' 84' ' ' HIS . 12.0 tp10 -54.17 -58.73 6.24 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-O 121.448 0.642 . . . . 0.0 110.014 173.406 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 61.4 t -56.09 -42.26 71.81 Favored 'Isoleucine or valine' 0 C--O 1.237 0.44 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.303 178.458 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.403 HG21 HG21 ' A' ' 71' ' ' ILE . 70.1 mt -60.71 -47.36 93.4 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.248 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.207 -179.231 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.481 HG22 ' CE1' ' A' ' 67' ' ' TYR . 60.3 p -59.57 -30.56 68.73 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 121.037 0.446 . . . . 0.0 110.8 -177.599 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 -87.01 -17.29 33.34 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 115.817 -0.629 . . . . 0.0 112.26 -175.949 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 43.3 p -121.66 3.6 10.11 Favored 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 -179.745 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.6 tp -61.53 -23.51 30.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 CA-C-O 120.776 0.322 . . . . 0.0 111.631 -175.79 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.416 HG23 ' HG3' ' A' ' 95' ' ' GLN . 9.7 t -67.28 -32.97 74.32 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.131 -178.964 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.416 ' HG3' HG23 ' A' ' 94' ' ' THR . 96.4 mt-30 -136.33 75.58 52.04 Favored Pre-proline 0 N--CA 1.464 0.274 0 N-CA-C 110.321 -0.251 . . . . 0.0 110.321 -178.603 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -92.76 176.45 1.62 Allowed 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 122.82 2.346 . . . . 0.0 112.713 179.13 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 75.4 p -117.31 178.28 4.43 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.426 175.519 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -57.19 -24.94 57.89 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 112.154 0.427 . . . . 0.0 112.154 -173.36 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 66.6 m80 -138.93 31.17 2.22 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 112.365 0.506 . . . . 0.0 112.365 -177.024 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 66.0 m -62.08 -21.57 65.06 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 121.078 0.465 . . . . 0.0 110.941 175.221 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -81.82 8.2 10.83 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.374 -179.676 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -60.79 -37.99 83.8 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 120.629 0.252 . . . . 0.0 110.479 -177.664 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.45 -43.23 99.22 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.661 177.499 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.34 -46.54 79.82 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.507 179.731 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.443 ' HG2' ' HB3' ' A' ' 44' ' ' TRP . 51.1 mt-30 -60.29 -41.81 94.16 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.007 177.719 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 106' ' ' SER . . . . . 0.675 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 45.7 t -55.82 -58.49 7.64 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.851 178.238 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 2.5 mmp_? -46.98 -59.05 3.37 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.584 -178.805 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.541 ' O ' ' HG3' ' A' ' 112' ' ' MET . 11.4 p -64.7 -33.35 62.7 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.552 -175.862 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 15.8 t80 -66.5 -43.54 85.02 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.2 -179.521 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' GLN . . . . . 0.675 ' HG3' ' O ' ' A' ' 106' ' ' SER . 31.1 mt-30 -62.7 -40.3 96.72 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 121.666 0.746 . . . . 0.0 109.014 177.599 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 89.7 mt -60.63 -41.0 94.01 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.531 -1.213 . . . . 0.0 110.415 176.956 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' MET . . . . . 0.541 ' HG3' ' O ' ' A' ' 108' ' ' VAL . 46.2 mtm -60.87 -39.66 90.01 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 177.338 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 113' ' ' GLU . . . . . 0.593 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 43.9 tt0 -61.42 -65.97 0.61 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.918 0.39 . . . . 0.0 110.208 179.104 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 114' ' ' GLN . . . . . 0.412 ' HG2' ' O ' ' A' ' 110' ' ' GLN . 10.7 pt20 -75.07 16.0 0.36 Allowed 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -172.843 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -141.99 -65.44 0.42 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.724 0.297 . . . . 0.0 110.686 173.967 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 4.2 m -68.21 -38.35 81.82 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.391 -176.351 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 117' ' ' TYR . . . . . 0.593 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 36.1 t80 -71.51 -40.83 69.88 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 110.285 -0.265 . . . . 0.0 110.285 -175.027 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 29.4 p -63.39 -43.56 97.23 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 120.921 0.391 . . . . 0.0 110.239 177.678 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 69.0 mtp85 -60.0 -40.49 89.4 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.003 174.904 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 58.3 t80 -66.58 -34.15 77.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.204 179.243 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 95.6 mt -65.27 -26.3 68.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.949 0.404 . . . . 0.0 110.249 175.562 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 122' ' ' LYS . . . . . 0.631 ' HE2' ' HA ' ' A' ' 122' ' ' LYS . 11.4 mmpt? -88.58 -16.44 32.52 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.335 179.263 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 59.1 p -61.66 139.9 58.24 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 120.99 0.424 . . . . 0.0 111.198 -177.161 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 16.6 p-10 -62.37 -31.31 71.95 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.814 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -64.43 -45.26 96.35 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.393 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 126' ' ' TYR . . . . . 0.451 ' O ' ' HG2' ' A' ' 130' ' ' MET . 69.5 t80 -69.12 -43.18 74.95 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 120.786 0.326 . . . . 0.0 110.333 -179.488 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 99.4 mt -60.42 -35.99 77.11 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.496 178.995 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -63.72 -38.99 93.2 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.347 177.215 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 91.8 mt -70.54 -27.52 64.22 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.986 179.263 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 130' ' ' MET . . . . . 0.451 ' HG2' ' O ' ' A' ' 126' ' ' TYR . 30.1 mmt . . . . . 0 N--CA 1.463 0.204 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.223 179.113 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.46 HG11 HD22 ' A' ' 129' ' ' LEU . 7.0 p . . . . . 0 CA--C 1.533 0.305 0 CA-C-O 121.491 0.662 . . . . 0.0 112.749 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.426 ' H ' ' HB3' ' A' ' 7' ' ' GLU . 32.2 t -133.66 150.28 74.38 Favored Pre-proline 0 CA--C 1.534 0.351 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 173.686 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_exo -43.38 -40.74 10.05 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.905 2.404 . . . . 0.0 113.018 179.87 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.536 ' O ' HG22 ' A' ' 9' ' ' VAL . 37.6 tt0 -66.81 -39.55 87.76 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 121.146 0.498 . . . . 0.0 110.453 178.744 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.426 ' HB3' ' H ' ' A' ' 4' ' ' SER . 18.3 tp10 -63.04 -35.84 81.57 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.232 0.539 . . . . 0.0 109.557 177.267 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.88 -45.2 93.66 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.553 -0.748 . . . . 0.0 111.346 -178.949 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.536 HG22 ' O ' ' A' ' 6' ' ' GLU . 24.6 m -67.56 -26.41 35.47 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.293 0 CA-C-O 120.765 0.317 . . . . 0.0 110.589 179.877 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.523 ' HG2' ' O ' ' A' ' 6' ' ' GLU . 74.3 mmtt -65.95 -29.5 69.92 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.263 0.554 . . . . 0.0 110.145 174.692 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 36.4 m0 -79.07 -30.07 43.75 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 174.321 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -69.64 -11.46 65.6 Favored Glycine 0 C--N 1.332 0.354 0 CA-C-N 115.286 -0.87 . . . . 0.0 112.65 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -106.83 -36.3 6.7 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 120.705 0.288 . . . . 0.0 110.778 175.547 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 46.4 t -123.85 105.5 9.69 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 120.905 0.383 . . . . 0.0 111.081 -176.184 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.409 ' O ' HD13 ' A' ' 19' ' ' LEU . 30.1 t80 -61.67 -33.64 74.34 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.995 177.391 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -61.15 -40.9 95.57 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.389 175.365 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.54 ' NZ ' ' HB2' ' A' ' 17' ' ' LYS . 4.1 ttmp? -69.75 -33.33 72.3 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.061 -178.457 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 67.6 tp -56.83 -48.52 77.84 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.029 173.864 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.409 HD13 ' O ' ' A' ' 15' ' ' PHE . 4.9 mp -76.0 -26.47 56.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.011 -179.619 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.0 t -72.92 -35.21 66.99 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.479 -178.613 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 -86.87 125.01 33.71 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.379 -0.601 . . . . 0.0 109.379 -178.88 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.442 ' O ' ' HB2' ' A' ' 26' ' ' GLU . 17.5 ttp180 -46.27 -47.27 18.2 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 122.87 0.468 . . . . 0.0 111.361 -178.283 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -58.59 -41.45 85.82 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.125 -179.172 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -67.09 -52.19 34.01 Favored Glycine 0 N--CA 1.449 -0.444 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.95 -177.434 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.1 tt -56.49 -40.94 75.81 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.091 0.472 . . . . 0.0 110.173 176.147 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.442 ' HB2' ' O ' ' A' ' 22' ' ' ARG . 1.1 tm-20 -59.04 -55.69 31.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.667 179.804 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.534 ' HA ' ' HD3' ' A' ' 30' ' ' ARG . . . -65.85 -39.29 90.61 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.8 -177.196 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -67.33 -40.94 85.96 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.919 -175.445 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 29.1 p -62.81 -45.01 94.61 Favored 'General case' 0 CA--C 1.529 0.147 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 178.238 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.534 ' HD3' ' HA ' ' A' ' 27' ' ' ALA . 53.0 mtp180 -54.23 -44.36 71.64 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.508 176.286 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.57 ' O ' HG22 ' A' ' 34' ' ' THR . 77.6 t80 -58.94 -48.2 82.34 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.756 178.542 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.412 HD23 HG22 ' A' ' 41' ' ' ILE . 14.2 tp -76.05 -10.9 59.79 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.012 -175.056 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -92.56 -9.87 39.64 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.552 177.847 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.57 HG22 ' O ' ' A' ' 31' ' ' PHE . 2.4 t -76.09 -15.57 60.07 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 121.517 0.675 . . . . 0.0 110.019 178.327 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.427 ' O ' ' N ' ' A' ' 37' ' ' SER . 7.9 pt-20 -145.9 90.58 1.99 Allowed 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 108.358 -0.978 . . . . 0.0 108.358 176.013 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 18.2 p90 -29.65 82.63 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 114.279 1.215 . . . . 0.0 114.279 -171.309 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' SER . . . . . 0.427 ' N ' ' O ' ' A' ' 35' ' ' GLU . 16.0 m -134.54 9.21 3.66 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 168.938 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -58.78 -32.13 69.02 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 114.1 -1.409 . . . . 0.0 111.603 -175.522 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.497 ' O ' ' HB2' ' A' ' 43' ' ' PHE . 5.1 mp0 -58.76 -20.21 47.52 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.645 -175.34 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.627 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 44.7 m-80 -75.81 -56.64 4.48 Favored 'General case' 0 C--O 1.241 0.646 0 CA-C-O 121.069 0.462 . . . . 0.0 111.092 -179.02 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.474 ' O ' HG13 ' A' ' 45' ' ' ILE . 10.0 tt -62.14 -43.84 98.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 179.511 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.606 ' HA ' ' HB ' ' A' ' 45' ' ' ILE . 52.1 mt-10 -72.75 -16.53 61.64 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.808 -179.009 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.627 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 66.5 t80 -61.27 -58.32 8.76 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 172.249 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.433 ' O ' ' HB3' ' A' ' 47' ' ' CYS . 37.1 p-90 -78.43 -15.21 58.9 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 119.404 -0.919 . . . . 0.0 111.493 -179.504 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.606 ' HB ' ' HA ' ' A' ' 42' ' ' GLU . 60.4 mt -69.03 -34.3 63.25 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.292 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 168.598 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.67 -31.84 73.13 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.965 -0.562 . . . . 0.0 109.784 173.865 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.433 ' HB3' ' O ' ' A' ' 44' ' ' TRP . 53.6 t -63.83 -33.6 76.05 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.587 173.946 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.452 ' HB3' ' O ' ' A' ' 45' ' ' ILE . 15.0 tp10 -66.16 -49.11 68.52 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 174.671 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.431 ' HA ' ' HG2' ' A' ' 52' ' ' LYS . 0.3 OUTLIER -66.66 -15.79 63.74 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.7 176.188 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.505 ' CZ ' HG23 ' A' ' 59' ' ' ILE . 92.7 t80 -78.44 -43.1 28.11 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.879 174.941 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.417 ' HD3' ' CE1' ' A' ' 99' ' ' HIS . 31.8 ttpt -61.13 -38.83 87.78 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.182 -179.359 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.431 ' HG2' ' HA ' ' A' ' 49' ' ' ASP . 21.9 ptmt -76.05 14.32 0.72 Allowed 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.665 -177.329 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.459 ' HB2' HD13 ' A' ' 59' ' ' ILE . 6.5 m -94.45 88.62 5.55 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 175.116 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.3 pptp? -74.27 -9.62 58.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.297 -177.186 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -91.19 118.52 5.43 Favored Glycine 0 N--CA 1.448 -0.505 0 N-CA-C 111.559 -0.617 . . . . 0.0 111.559 175.562 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.464 ' O ' ' HB ' ' A' ' 59' ' ' ILE . 19.3 Cg_endo -56.65 -30.33 83.24 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.847 2.365 . . . . 0.0 112.019 -176.991 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' GLN . . . . . 0.412 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 73.2 mt-30 -71.88 -45.32 61.72 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.916 -0.583 . . . . 0.0 109.858 177.805 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 50.9 tp60 -59.0 -33.13 70.36 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.848 179.256 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.505 HG23 ' CZ ' ' A' ' 50' ' ' PHE . 23.1 mm -55.24 -56.69 10.12 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.732 174.369 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 23.5 m80 -59.73 -39.78 85.82 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.211 -176.632 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 57' ' ' GLN . 94.6 mt -58.02 -59.61 5.01 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.387 -177.318 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 58.1 mtmt -72.4 -25.39 61.47 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.401 -176.475 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.61 -49.2 74.24 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 120.954 0.407 . . . . 0.0 110.579 176.711 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -63.83 -37.35 87.05 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.546 -179.207 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.9 -52.97 63.46 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.922 179.115 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 68.7 mt -63.53 -35.35 72.24 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.295 179.503 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.519 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 81.3 t80 -54.96 -63.9 1.01 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.7 177.884 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -63.55 -37.53 87.66 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.813 -173.713 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -81.52 -25.09 36.22 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.811 -173.462 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -130.37 -58.8 1.05 Allowed 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 -174.409 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.519 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 51.2 mm -66.81 -29.05 45.06 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -170.202 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -59.31 144.63 45.89 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.599 -177.506 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 16.9 p -61.63 -58.5 7.84 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.956 0.408 . . . . 0.0 109.928 176.824 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -87.59 85.8 7.13 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 172.083 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -117.03 153.09 49.5 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.932 -175.802 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -74.5 9.58 1.82 Allowed 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 122.811 2.341 . . . . 0.0 112.666 178.59 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.622 ' HE3' ' HA ' ' A' ' 77' ' ' LYS . 0.0 OUTLIER -137.61 -52.59 0.65 Allowed 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 122.457 0.303 . . . . 0.0 110.218 177.568 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 64.81 112.7 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.478 0 O-C-N 123.644 0.59 . . . . 0.0 111.301 -179.621 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 39.7 t -104.34 142.07 18.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.022 -0.535 . . . . 0.0 109.871 179.445 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -78.19 19.93 0.42 Allowed 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.992 0.425 . . . . 0.0 111.0 -180.0 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 28.4 tp -60.29 145.05 48.97 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.223 178.058 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -47.51 128.34 12.35 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.236 176.391 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -61.89 -37.1 83.32 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.93 -176.313 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' HIS . . . . . 0.432 ' O ' HG23 ' A' ' 88' ' ' VAL . 76.7 t60 -66.57 -35.85 81.23 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.664 0.268 . . . . 0.0 110.454 179.112 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 42.4 m -63.7 -44.43 93.7 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.128 0.489 . . . . 0.0 109.826 174.488 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.465 ' O ' HG23 ' A' ' 90' ' ' THR . 57.9 mtpt -62.38 -35.23 78.53 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.98 176.18 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -62.79 -45.08 94.3 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.793 179.738 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.432 HG23 ' O ' ' A' ' 84' ' ' HIS . 74.9 t -58.44 -43.08 85.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.072 0.463 . . . . 0.0 109.981 177.081 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 70.0 mt -68.65 -41.55 82.79 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.248 -177.896 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.465 HG23 ' O ' ' A' ' 86' ' ' LYS . 43.3 p -62.4 -29.74 70.7 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.837 0.351 . . . . 0.0 111.114 -178.505 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 -85.66 -35.99 20.57 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.032 178.138 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 32.6 t -87.04 -3.46 59.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.438 -0.347 . . . . 0.0 111.485 -176.609 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.1 tp -57.4 -32.3 40.93 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 N-CA-C 111.763 0.283 . . . . 0.0 111.763 -176.436 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 14.6 t -72.98 -31.19 64.37 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 120.739 0.304 . . . . 0.0 110.648 -178.718 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 79.2 mm-40 -142.4 79.11 15.9 Favored Pre-proline 0 C--O 1.233 0.19 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 177.86 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_endo -78.61 157.07 28.35 Favored 'Trans proline' 0 C--O 1.238 0.497 0 C-N-CA 122.614 2.21 . . . . 0.0 112.344 -177.905 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 41.2 p -85.15 179.69 7.19 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.422 177.224 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.411 ' HG ' ' HG3' ' A' ' 51' ' ' LYS . 41.0 tp -57.3 -34.23 68.49 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.607 -176.21 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 99' ' ' HIS . . . . . 0.533 ' O ' ' N ' ' A' ' 101' ' ' PHE . 41.9 m-70 -107.44 -28.75 9.64 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 119.622 -0.228 . . . . 0.0 111.15 177.09 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 47.1 t 52.06 -76.6 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 123.197 0.599 . . . . 0.0 111.694 178.102 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.533 ' N ' ' O ' ' A' ' 99' ' ' HIS . 34.7 m-85 -70.58 5.46 1.84 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.217 0.607 . . . . 0.0 110.981 179.542 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 102' ' ' ASP . . . . . 0.503 ' HB2' ' CB ' ' A' ' 99' ' ' HIS . 12.9 t70 -37.49 -54.49 1.13 Allowed 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.343 0.657 . . . . 0.0 112.249 174.595 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.45 -39.78 80.79 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 121.194 0.521 . . . . 0.0 110.771 -179.533 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.82 -30.73 69.34 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.635 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.411 ' HB3' ' O ' ' A' ' 102' ' ' ASP . 21.7 tm0? -58.66 -51.27 70.66 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.623 178.181 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 22.2 m -59.72 -44.62 93.64 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.67 179.645 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' ARG . . . . . 0.45 ' O ' ' HG ' ' A' ' 111' ' ' LEU . 25.5 mmt180 -55.16 -62.58 1.57 Allowed 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.123 179.41 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 66.2 t -63.02 -37.53 79.6 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.119 -175.641 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 30.1 t80 -55.06 -53.3 57.57 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.966 179.223 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 110' ' ' GLN . . . . . 0.413 ' HG3' ' O ' ' A' ' 107' ' ' ARG . 5.2 pp0? -71.6 -28.99 64.19 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 121.177 -0.209 . . . . 0.0 110.998 -176.896 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' ' 107' ' ' ARG . 84.5 mt -60.17 -47.62 85.15 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 120.974 0.416 . . . . 0.0 110.219 175.632 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 112' ' ' MET . . . . . 0.449 ' SD ' ' HB ' ' A' ' 41' ' ' ILE . 36.9 mtm -69.56 -37.82 77.18 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.281 178.989 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 113' ' ' GLU . . . . . 0.65 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 40.2 tt0 -58.73 -61.92 2.25 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.695 -177.434 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -53.95 -28.54 37.99 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 -172.28 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -117.91 -61.92 1.62 Allowed 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 -176.19 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 9.2 m -64.7 -34.49 78.42 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.29 -0.414 . . . . 0.0 112.066 -173.583 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 117' ' ' TYR . . . . . 0.65 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 17.9 t80 -64.68 -54.45 31.41 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 120.442 0.163 . . . . 0.0 111.308 -175.503 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 14.2 t -61.65 -34.67 76.11 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.021 0.439 . . . . 0.0 110.435 -179.68 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 32.2 ttt180 -69.12 -37.41 78.33 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.864 179.103 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 82.8 t80 -60.0 -41.02 91.18 Favored 'General case' 0 C--N 1.334 -0.094 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.805 175.916 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 86.9 mt -61.84 -31.54 71.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.561 177.915 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 15.4 tptm -95.55 -2.65 48.05 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.689 -177.206 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 56.4 p -72.56 159.52 33.76 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 120.741 0.305 . . . . 0.0 110.888 -178.709 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -55.12 -34.4 63.68 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.106 175.061 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 68.6 mt -59.41 -53.68 44.82 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.231 -178.23 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 70.0 t80 -68.24 -38.96 82.38 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.656 0.265 . . . . 0.0 110.345 -177.986 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 93.0 mt -61.99 -32.59 73.07 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 120.882 0.372 . . . . 0.0 110.439 177.892 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -68.39 -35.98 78.48 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.971 176.055 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.46 HD22 HG11 ' A' ' 3' ' ' VAL . 94.0 mt -78.04 -11.93 59.95 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.013 178.899 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 130' ' ' MET . . . . . . . . . . . . . 4.2 mmt . . . . . 0 C--N 1.331 -0.21 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.867 178.748 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.461 HG21 ' CH2' ' A' ' 11' ' ' TRP . 3.1 p . . . . . 0 C--O 1.233 0.195 0 CA-C-O 120.758 0.313 . . . . 0.0 110.362 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.0 p -103.36 148.77 36.21 Favored Pre-proline 0 C--N 1.327 -0.383 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 175.096 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_exo -51.78 -24.89 19.36 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 122.836 2.357 . . . . 0.0 112.617 178.355 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.05 -40.92 95.45 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.406 0.622 . . . . 0.0 109.5 176.102 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.41 ' HB3' HG23 ' A' ' 3' ' ' VAL . 9.3 tp10 -74.0 -30.25 62.37 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.803 176.616 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.17 -52.68 61.42 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.727 178.784 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 27.0 m -65.1 -27.01 41.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.487 177.035 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.557 ' O ' ' HD2' ' A' ' 17' ' ' LYS . 5.0 tppt? -61.71 -46.5 89.41 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 175.84 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.461 ' CH2' HG21 ' A' ' 3' ' ' VAL . 47.9 m0 -59.64 -28.81 67.56 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.44 177.507 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -60.3 -17.23 45.72 Favored Glycine 0 C--N 1.334 0.452 0 CA-C-N 115.602 -0.726 . . . . 0.0 112.465 177.885 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -76.22 -48.51 20.09 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 120.727 0.299 . . . . 0.0 110.952 177.622 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 38.8 m -146.35 121.71 10.29 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-O 121.064 0.459 . . . . 0.0 112.161 -172.23 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.414 ' O ' HD13 ' A' ' 19' ' ' LEU . 22.4 t80 -52.05 -28.38 17.11 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.093 174.303 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -54.27 -58.52 7.09 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.454 175.946 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.557 ' HD2' ' O ' ' A' ' 10' ' ' LYS . 0.4 OUTLIER -72.15 -16.77 61.98 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.849 -174.058 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 63.0 tp -65.85 -42.91 89.86 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 121.107 0.479 . . . . 0.0 109.764 171.316 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.414 HD13 ' O ' ' A' ' 15' ' ' PHE . 2.7 mp -78.63 -42.43 28.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.529 -176.713 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.553 ' OG ' ' HA ' ' A' ' 17' ' ' LYS . 12.7 p -65.91 -22.94 66.54 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 120.88 0.371 . . . . 0.0 111.091 -178.379 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -82.66 108.92 16.4 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 174.964 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.5 ptm180 -40.81 -37.33 0.75 Allowed 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.011 0.524 . . . . 0.0 111.806 177.434 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -77.34 -35.31 54.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.133 -178.678 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -68.59 -51.88 28.56 Favored Glycine 0 C--N 1.331 0.259 0 N-CA-C 111.417 -0.673 . . . . 0.0 111.417 179.519 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.7 tt -55.55 -37.4 67.93 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.846 -0.428 . . . . 0.0 109.846 174.233 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.564 ' O ' ' HG3' ' A' ' 30' ' ' ARG . 43.0 tt0 -62.34 -47.82 82.55 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.674 178.709 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -66.57 -40.52 89.01 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.108 0.48 . . . . 0.0 110.327 179.123 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -65.34 -41.53 93.83 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.958 -177.013 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.476 HG22 ' O ' ' A' ' 26' ' ' GLU . 10.4 t -66.36 -36.11 82.05 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 120.559 0.219 . . . . 0.0 110.693 -179.0 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.564 ' HG3' ' O ' ' A' ' 26' ' ' GLU . 49.3 mtt180 -59.27 -43.57 92.48 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 121.17 0.51 . . . . 0.0 110.067 177.166 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.582 ' O ' HG22 ' A' ' 34' ' ' THR . 87.9 t80 -72.81 -46.67 51.91 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.778 -179.819 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 20.8 tp -60.28 -26.37 66.43 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.575 -173.278 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.411 ' NZ ' ' OG1' ' A' ' 29' ' ' THR . 46.5 mttp -66.12 -18.57 65.43 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 112.276 0.473 . . . . 0.0 112.276 -179.522 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.582 HG22 ' O ' ' A' ' 31' ' ' PHE . 5.9 t -77.09 -21.06 54.91 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 120.68 0.276 . . . . 0.0 110.84 -179.171 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -111.66 -7.07 14.28 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.965 -178.654 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 62.02 17.29 8.91 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.87 -0.605 . . . . 0.0 112.036 175.681 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 32.0 t -78.47 6.54 8.31 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.479 0.656 . . . . 0.0 110.128 178.246 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -64.2 -19.16 65.15 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.605 -176.378 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -58.61 -29.08 66.2 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 121.104 0.478 . . . . 0.0 110.178 177.681 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.602 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 90.5 m-20 -73.82 -50.39 20.66 Favored 'General case' 0 C--O 1.242 0.678 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.029 -179.215 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.473 HG13 ' CZ2' ' A' ' 44' ' ' TRP . 13.3 tt -63.96 -42.36 95.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 -179.816 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.54 ' HA ' ' HB ' ' A' ' 45' ' ' ILE . 48.8 mt-10 -65.92 -26.48 67.62 Favored 'General case' 0 N--CA 1.461 0.124 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.77 177.962 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.602 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 37.9 t80 -56.6 -61.35 2.48 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 116.583 -0.28 . . . . 0.0 110.291 175.869 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.473 ' CZ2' HG13 ' A' ' 41' ' ' ILE . 39.9 p-90 -78.68 -18.29 54.61 Favored 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 119.432 -0.907 . . . . 0.0 111.555 -178.072 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.54 ' HB ' ' HA ' ' A' ' 42' ' ' GLU . 24.0 mt -64.13 -37.37 79.7 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.287 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 169.771 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.04 -35.61 81.28 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.7 174.849 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.83 ' SG ' ' HB2' ' A' ' 101' ' ' PHE . 41.6 t -64.89 -36.09 83.23 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.819 175.131 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.598 ' HA ' ' HB3' ' A' ' 51' ' ' LYS . 15.7 mt-10 -77.95 -25.02 47.98 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 121.009 -0.276 . . . . 0.0 110.56 177.851 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -64.34 -38.56 91.48 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.851 0.834 . . . . 0.0 108.816 171.005 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -64.73 -37.74 88.62 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.405 -1.271 . . . . 0.0 110.102 172.462 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.598 ' HB3' ' HA ' ' A' ' 48' ' ' GLU . 4.7 tmtm? -70.59 -23.1 62.51 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.473 178.65 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.481 ' HG3' ' O ' ' A' ' 48' ' ' GLU . 57.6 mtpt -57.83 -37.11 73.25 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.164 0.507 . . . . 0.0 110.779 177.25 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.414 ' CB ' ' HG2' ' A' ' 58' ' ' GLN . 10.2 p -91.11 154.26 19.49 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.076 -177.055 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.01 9.66 4.9 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.977 -179.13 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' GLY . . . . . 0.436 ' O ' HG12 ' A' ' 59' ' ' ILE . . . -83.28 121.23 5.41 Favored Glycine 0 C--N 1.332 0.356 0 N-CA-C 111.465 -0.654 . . . . 0.0 111.465 176.167 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_endo -55.34 -31.7 78.19 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 122.871 2.381 . . . . 0.0 112.768 -174.284 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' GLN . . . . . 0.51 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 24.6 mp0 -67.12 -51.33 55.36 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 176.897 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.414 ' HG2' ' CB ' ' A' ' 53' ' ' SER . 7.9 tp60 -55.27 -38.92 69.2 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.414 179.008 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.436 HG12 ' O ' ' A' ' 55' ' ' GLY . 39.9 mm -52.3 -57.82 3.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.056 179.757 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 76.3 m80 -64.37 -37.52 87.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.556 -0.293 . . . . 0.0 111.094 -176.798 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 57' ' ' GLN . 89.0 mt -58.26 -60.9 3.04 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-O 120.865 0.364 . . . . 0.0 110.962 -179.141 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -65.37 -45.24 84.88 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.234 -177.395 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.8 -49.26 77.21 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.82 0.343 . . . . 0.0 111.333 -178.104 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -66.26 -30.77 71.28 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.488 -177.391 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -69.73 -53.98 15.88 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.527 178.375 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 74.3 mt -58.21 -35.49 53.42 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 CA-C-O 121.324 0.583 . . . . 0.0 110.078 177.799 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 85.5 t80 -56.04 -58.27 8.6 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.622 177.969 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -71.63 -25.42 62.15 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.092 -0.504 . . . . 0.0 112.218 -175.752 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 65.7 tttp -86.78 -29.02 22.63 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 111.566 0.21 . . . . 0.0 111.566 -176.705 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -127.76 -53.94 1.33 Allowed 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -174.754 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 45.2 mm -71.51 -19.77 20.69 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 CA-C-O 120.77 0.319 . . . . 0.0 111.575 -171.238 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.501 ' HB3' ' HB2' ' A' ' 75' ' ' ALA . 53.9 tp60 -51.74 135.89 28.5 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.811 178.544 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 19.3 p -50.8 -49.79 57.65 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.942 -176.119 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -85.89 -62.89 1.42 Allowed 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 174.991 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.501 ' HB2' ' HB3' ' A' ' 72' ' ' GLN . . . 60.09 158.57 0.11 Allowed Pre-proline 0 N--CA 1.469 0.485 0 C-N-CA 122.996 0.518 . . . . 0.0 112.253 176.316 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -70.18 -23.76 28.53 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.218 1.945 . . . . 0.0 111.26 173.097 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -95.81 -41.11 9.0 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.079 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 55.81 88.52 0.04 OUTLIER 'General case' 0 C--O 1.234 0.266 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 -172.142 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.477 HG12 ' H ' ' A' ' 81' ' ' LEU . 24.3 t -90.91 126.34 43.64 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.683 -172.499 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 37.1 m-80 -74.73 15.89 0.33 Allowed 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.591 -177.442 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.477 ' H ' HG12 ' A' ' 79' ' ' VAL . 16.8 tp -57.17 146.97 26.23 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.212 -0.449 . . . . 0.0 109.883 174.734 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -46.89 131.07 12.12 Favored 'General case' 0 C--O 1.237 0.414 0 O-C-N 123.606 0.566 . . . . 0.0 112.39 -176.524 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 36.6 p90 -55.94 -44.98 78.89 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.155 -0.93 . . . . 0.0 111.744 -177.39 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' HIS . . . . . 0.455 ' O ' HG23 ' A' ' 88' ' ' VAL . 81.1 t60 -67.92 -32.83 73.56 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.83 0.348 . . . . 0.0 110.32 -176.661 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 49.7 m -65.86 -47.19 75.75 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.025 176.696 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.421 ' HE2' ' O ' ' A' ' 81' ' ' LEU . 58.0 mtmt -65.06 -30.72 71.7 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.151 176.959 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -63.52 -50.0 71.31 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.827 179.035 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.455 HG23 ' O ' ' A' ' 84' ' ' HIS . 91.8 t -56.77 -44.91 82.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 121.003 0.43 . . . . 0.0 110.173 178.489 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 70.5 mt -63.22 -47.43 92.3 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.073 -178.768 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 20.2 p -61.64 -26.07 67.77 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 120.763 0.316 . . . . 0.0 111.681 -176.941 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 42.0 m-80 -94.85 -14.69 24.35 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 111.663 0.245 . . . . 0.0 111.663 178.907 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 33.0 m -108.45 -4.77 17.03 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 111.664 0.246 . . . . 0.0 111.664 -177.873 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.448 ' O ' ' HD3' ' A' ' 96' ' ' PRO . 9.6 tp -61.35 -18.72 18.99 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 CA-C-O 120.878 0.371 . . . . 0.0 111.363 -177.757 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.524 HG23 ' HG2' ' A' ' 95' ' ' GLN . 8.9 t -60.72 -29.55 69.43 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.595 177.667 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.524 ' HG2' HG23 ' A' ' 94' ' ' THR . 12.8 pt20 -149.2 77.44 9.05 Favored Pre-proline 0 CA--C 1.532 0.288 0 CA-C-O 121.351 0.596 . . . . 0.0 110.172 178.123 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 96' ' ' PRO . . . . . 0.448 ' HD3' ' O ' ' A' ' 93' ' ' ILE . 72.3 Cg_endo -73.78 129.76 13.86 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.602 2.201 . . . . 0.0 112.125 -178.033 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 68.7 p -85.04 175.3 9.11 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.29 177.615 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 31.1 tp -60.56 -19.12 56.5 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 121.434 0.635 . . . . 0.0 110.675 -179.118 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' HIS . . . . . 0.79 ' HB3' ' HB2' ' A' ' 102' ' ' ASP . 28.5 m-70 -128.49 39.16 3.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.987 178.226 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 22.4 t -59.41 -30.99 68.86 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.121 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.83 ' HB2' ' SG ' ' A' ' 47' ' ' CYS . 59.0 m-85 -104.38 19.74 19.72 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.578 -178.704 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 102' ' ' ASP . . . . . 0.79 ' HB2' ' HB3' ' A' ' 99' ' ' HIS . 24.2 t70 -58.88 -43.07 90.84 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.265 -175.786 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.463 ' O ' ' HG2' ' A' ' 107' ' ' ARG . . . -68.66 -41.29 79.51 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.105 179.232 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -58.42 -39.9 81.05 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.166 178.035 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.463 ' HG2' ' HB2' ' A' ' 44' ' ' TRP . 23.0 tm0? -57.54 -51.27 70.15 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.769 177.833 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 36.3 t -63.61 -37.08 85.98 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.159 -178.102 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 107' ' ' ARG . . . . . 0.529 ' O ' ' HG ' ' A' ' 111' ' ' LEU . 12.3 mmm180 -67.25 -46.88 72.41 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.504 0.192 . . . . 0.0 111.095 -178.553 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 61.4 t -68.85 -34.99 67.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 121.348 0.594 . . . . 0.0 109.927 177.94 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -55.49 -51.75 65.94 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.548 175.087 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' GLN . . . . . 0.478 ' O ' ' HG2' ' A' ' 114' ' ' GLN . 13.7 pt20 -69.68 -29.67 67.16 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.068 -177.819 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 107' ' ' ARG . 80.9 mt -63.02 -43.55 98.42 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 120.907 0.384 . . . . 0.0 110.465 177.295 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 43.5 mtm -74.27 -28.52 61.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.024 0.44 . . . . 0.0 110.06 177.605 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 113' ' ' GLU . . . . . 0.609 ' HA ' ' HB3' ' A' ' 117' ' ' TYR . 8.2 tm-20 -60.28 -65.48 0.68 Allowed 'General case' 0 C--O 1.236 0.373 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.333 179.211 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 114' ' ' GLN . . . . . 0.478 ' HG2' ' O ' ' A' ' 110' ' ' GLN . 14.6 pt20 -56.22 -28.7 59.33 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 -174.468 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -105.91 -62.38 1.38 Allowed 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -176.473 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 12.9 m -75.93 -37.95 58.17 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 111.933 0.345 . . . . 0.0 111.933 -173.346 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 117' ' ' TYR . . . . . 0.609 ' HB3' ' HA ' ' A' ' 113' ' ' GLU . 25.6 t80 -72.83 -40.43 65.77 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.775 -0.193 . . . . 0.0 111.136 -174.328 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 24.6 p -57.57 -53.22 60.68 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-O 121.368 0.604 . . . . 0.0 109.851 175.653 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 119' ' ' ARG . . . . . 0.436 HH11 ' HD3' ' A' ' 119' ' ' ARG . 28.9 mtp-105 -58.75 -38.47 78.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.007 177.119 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -61.6 -39.18 90.31 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.735 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.488 HD11 ' CZ ' ' A' ' 117' ' ' TYR . 82.4 mt -70.09 -27.24 64.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.816 0.341 . . . . 0.0 110.88 179.167 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 122' ' ' LYS . . . . . 0.76 ' HE3' ' HA ' ' A' ' 122' ' ' LYS . 0.2 OUTLIER -100.41 1.49 41.37 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.112 -178.979 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 83.5 p -64.68 148.14 51.62 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 120.778 0.323 . . . . 0.0 110.838 -177.587 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -63.06 -35.28 79.71 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.523 -178.602 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 6.4 tp -64.12 -40.37 88.8 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.864 178.002 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 83.2 t80 -60.34 -43.09 96.77 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.145 0.498 . . . . 0.0 109.893 178.28 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 69.4 mt -66.12 -31.52 72.42 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.436 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -64.84 -38.77 92.09 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.997 176.676 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 86.6 mt -61.7 -40.71 95.98 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.927 175.893 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 130' ' ' MET . . . . . . . . . . . . . 86.9 mmm . . . . . 0 C--O 1.234 0.24 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.412 179.45 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.5 p . . . . . 0 CA--C 1.531 0.226 0 CA-C-O 120.699 0.285 . . . . 0.0 111.239 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.0 m -86.72 148.25 45.62 Favored Pre-proline 0 CA--C 1.534 0.33 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 175.286 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -53.63 -30.63 56.27 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.743 2.295 . . . . 0.0 113.04 -173.978 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 28.5 tp10 -60.52 -43.15 97.45 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 121.173 0.511 . . . . 0.0 110.303 177.155 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -76.55 -32.5 58.24 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.944 179.478 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.14 -49.91 70.28 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.848 179.19 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 33.7 m -66.9 -28.34 42.69 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 177.539 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.568 ' O ' ' HD2' ' A' ' 17' ' ' LYS . 8.4 tppt? -57.85 -48.85 78.59 Favored 'General case' 0 CA--C 1.527 0.094 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.388 176.523 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.437 ' HB3' HD13 ' A' ' 18' ' ' LEU . 49.1 m0 -59.54 -33.11 70.97 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.505 178.224 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -69.11 -8.18 58.07 Favored Glycine 0 C--N 1.331 0.281 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.903 -178.607 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -79.37 -34.14 42.29 Favored 'General case' 0 C--N 1.33 -0.248 0 O-C-N 122.839 -0.212 . . . . 0.0 110.618 177.647 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.477 ' HB3' ' HG2' ' A' ' 17' ' ' LYS . 35.5 t -161.0 129.26 4.43 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 120.996 0.427 . . . . 0.0 111.56 -176.01 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.45 ' O ' HD13 ' A' ' 19' ' ' LEU . 10.1 t80 -58.23 -27.61 64.1 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.597 175.775 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -60.78 -48.71 80.56 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.048 177.951 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.568 ' HD2' ' O ' ' A' ' 10' ' ' LYS . 19.3 ptpt -80.19 -11.74 59.71 Favored 'General case' 0 C--O 1.233 0.192 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.796 -177.007 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.437 HD13 ' HB3' ' A' ' 11' ' ' TRP . 60.0 tp -69.0 -45.93 69.32 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 170.411 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.45 HD13 ' O ' ' A' ' 15' ' ' PHE . 8.0 mp -61.83 -30.31 70.75 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.839 176.268 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.4 t -58.12 -21.13 45.19 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.168 178.439 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' HIS . . . . . 0.474 ' HB3' ' H ' ' A' ' 24' ' ' GLY . 0.8 OUTLIER -102.41 136.5 42.12 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 176.634 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.03 -47.56 50.89 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 121.137 0.494 . . . . 0.0 110.098 177.329 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 30.2 p-10 -69.78 -33.9 73.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.277 178.897 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.474 ' H ' ' HB3' ' A' ' 21' ' ' HIS . . . -64.14 -45.5 93.57 Favored Glycine 0 C--N 1.333 0.377 0 N-CA-C 111.388 -0.685 . . . . 0.0 111.388 173.363 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.5 tp -53.38 -52.4 59.41 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.365 0.603 . . . . 0.0 110.158 174.067 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.644 ' O ' ' HG2' ' A' ' 30' ' ' ARG . 27.9 tt0 -60.33 -42.4 95.56 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.514 -177.663 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.4 ' O ' ' HB2' ' A' ' 30' ' ' ARG . . . -55.21 -47.3 75.51 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-O 121.28 0.562 . . . . 0.0 110.134 177.669 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 90.6 t80 -59.92 -49.09 79.04 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.633 178.236 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.563 HG22 ' HA ' ' A' ' 26' ' ' GLU . 6.0 t -65.88 -24.57 66.88 Favored 'General case' 0 C--O 1.225 -0.211 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.571 -177.243 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.644 ' HG2' ' O ' ' A' ' 26' ' ' GLU . 31.5 mmt180 -57.56 -48.96 77.91 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 173.391 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.601 ' O ' HG22 ' A' ' 34' ' ' THR . 86.5 t80 -69.73 -33.83 73.02 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.655 178.434 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.46 HD23 ' HB ' ' A' ' 41' ' ' ILE . 27.5 tp -72.71 -26.19 61.5 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 121.005 0.431 . . . . 0.0 110.916 -178.241 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.491 ' HG3' ' O ' ' A' ' 29' ' ' THR . 28.2 mtpp -75.4 -38.29 59.97 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.091 179.652 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.601 HG22 ' O ' ' A' ' 31' ' ' PHE . 12.0 t -68.18 -15.96 63.79 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 120.804 0.335 . . . . 0.0 110.825 -176.689 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -109.55 23.78 13.97 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.265 175.437 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 50.4 p90 45.12 26.24 0.22 Allowed 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.603 1.161 . . . . 0.0 113.587 174.893 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 10.4 t -108.04 20.13 19.11 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.043 0.449 . . . . 0.0 110.193 -179.219 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.631 ' O ' HG22 ' A' ' 41' ' ' ILE . 10.2 pt-20 -63.34 -22.44 66.88 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.564 -176.603 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -53.02 -26.37 15.3 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.662 0.268 . . . . 0.0 111.263 -179.584 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.433 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 8.4 m120 -67.12 -49.7 63.99 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-O 121.047 0.451 . . . . 0.0 110.447 177.761 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.631 HG22 ' O ' ' A' ' 38' ' ' GLU . 6.3 tp -63.85 -42.75 96.87 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.122 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.197 -176.555 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -71.63 -25.84 62.32 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.26 -178.193 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.445 ' HE1' ' HB3' ' A' ' 70' ' ' PHE . 41.3 t80 -60.57 -67.86 0.36 Allowed 'General case' 0 C--O 1.237 0.412 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.969 179.483 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.512 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 35.6 p-90 -75.96 -23.57 55.36 Favored 'General case' 0 C--O 1.225 -0.187 0 C-N-CA 119.402 -0.919 . . . . 0.0 111.954 -174.821 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 26.4 mt -57.9 -38.67 67.58 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 C-N-CA 120.405 -0.518 . . . . 0.0 109.769 172.237 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.407 ' O ' ' HB2' ' A' ' 49' ' ' ASP . . . -66.03 -37.24 85.39 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 121.137 0.494 . . . . 0.0 110.034 175.19 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.575 ' O ' ' HB3' ' A' ' 50' ' ' PHE . 71.6 m -72.15 -17.17 61.98 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.297 177.685 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.512 ' HG2' ' O ' ' A' ' 44' ' ' TRP . 12.3 mm-40 -73.98 -37.36 64.48 Favored 'General case' 0 C--O 1.225 -0.22 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 171.286 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.461 ' O ' ' HB2' ' A' ' 52' ' ' LYS . 5.8 m-20 -59.12 -29.77 67.64 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 172.149 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.575 ' HB3' ' O ' ' A' ' 47' ' ' CYS . 85.2 t80 -64.43 -40.61 96.08 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.971 173.875 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.566 ' HE3' ' CE1' ' A' ' 99' ' ' HIS . 60.0 mttp -58.87 -31.78 68.87 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.091 0.472 . . . . 0.0 110.236 173.552 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.56 ' N ' ' HE2' ' A' ' 52' ' ' LYS . 1.1 mpmm? -70.1 -24.73 63.25 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.419 -179.851 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.475 ' HB3' ' HG3' ' A' ' 58' ' ' GLN . 39.1 m -60.73 127.42 31.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.714 0.768 . . . . 0.0 110.963 -177.289 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 28.5 tptp -110.58 128.7 55.77 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 114.647 -1.161 . . . . 0.0 110.152 -176.072 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 100.68 131.64 7.46 Favored Glycine 0 CA--C 1.519 0.282 0 N-CA-C 111.701 -0.56 . . . . 0.0 111.701 -178.292 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -54.54 -46.52 32.84 Favored 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 122.794 2.329 . . . . 0.0 111.847 -178.492 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -53.7 -48.0 69.96 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.058 0.456 . . . . 0.0 110.282 178.996 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.475 ' HG3' ' HB3' ' A' ' 53' ' ' SER . 8.4 tp-100 -55.57 -42.77 75.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.121 177.033 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.537 HG22 ' HG2' ' A' ' 96' ' ' PRO . 47.5 mm -60.85 -39.9 83.44 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.024 179.334 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 74.7 m80 -61.93 -55.02 33.84 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 120.673 0.273 . . . . 0.0 110.854 -179.207 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.539 HD12 ' N ' ' A' ' 62' ' ' LYS . 4.2 pp -67.69 -35.66 79.23 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.357 -176.217 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.539 ' N ' HD12 ' A' ' 61' ' ' LEU . 32.0 mmtp -65.67 -38.8 90.31 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 120.946 0.403 . . . . 0.0 110.005 176.363 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.83 -49.03 79.13 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.751 179.68 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 53.7 mmtt -54.26 -43.07 70.64 Favored 'General case' 0 N--CA 1.466 0.351 0 O-C-N 123.273 0.358 . . . . 0.0 111.191 178.256 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.02 -61.07 2.55 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.064 -179.895 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 63.9 mt -64.08 -37.6 80.27 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-O 121.334 0.588 . . . . 0.0 110.586 -178.78 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -57.24 -57.39 12.84 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.179 -177.135 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -78.15 -23.04 47.9 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.919 -172.796 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -99.76 -16.82 17.98 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -174.997 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' PHE . . . . . 0.445 ' HB3' ' HE1' ' A' ' 43' ' ' PHE . 97.3 m-85 -132.56 -49.17 0.9 Allowed 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 -176.405 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 50.6 mm -74.89 -32.51 27.88 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -169.725 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 51.2 mm-40 -64.67 143.44 57.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.98 0.419 . . . . 0.0 111.556 179.818 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 22.1 m -62.46 -28.94 70.17 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.212 177.223 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -98.47 24.43 7.38 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.501 -178.211 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -89.57 152.31 47.03 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.58 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_exo -67.34 15.81 0.13 Allowed 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 123.248 2.632 . . . . 0.0 113.732 -177.165 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -130.4 -27.21 2.21 Favored 'General case' 0 C--N 1.331 -0.238 0 O-C-N 122.333 -0.229 . . . . 0.0 111.236 177.852 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 48.73 42.21 19.27 Favored 'General case' 0 N--CA 1.466 0.353 0 O-C-N 123.498 0.499 . . . . 0.0 110.937 177.055 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 58.3 t -47.47 133.34 4.42 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 CA-C-N 115.264 -0.88 . . . . 0.0 111.848 -174.653 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -70.84 76.46 0.62 Allowed 'General case' 0 C--O 1.237 0.413 0 CA-C-O 121.283 0.563 . . . . 0.0 110.911 -178.558 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.569 HD23 ' HB3' ' A' ' 86' ' ' LYS . 55.2 tp -113.79 144.68 42.59 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.32 -0.854 . . . . 0.0 109.918 177.075 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -67.2 145.73 54.92 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 120.815 0.341 . . . . 0.0 110.91 178.644 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 91.7 t80 -58.32 -50.85 72.16 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.465 -176.602 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' HIS . . . . . 0.438 ' O ' ' HB3' ' A' ' 87' ' ' GLU . 85.7 t60 -61.14 -33.26 73.12 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.615 0.245 . . . . 0.0 111.176 -175.61 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 25.7 m -69.03 -50.13 51.43 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.805 0.336 . . . . 0.0 110.79 178.671 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.569 ' HB3' HD23 ' A' ' 81' ' ' LEU . 12.2 ptmm? -70.69 -19.96 62.73 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.084 0.468 . . . . 0.0 110.295 178.645 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.438 ' HB3' ' O ' ' A' ' 84' ' ' HIS . 37.1 tt0 -61.84 -54.77 37.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.613 173.6 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 84' ' ' HIS . 59.2 t -55.01 -41.24 57.65 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.215 178.077 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 73.2 mt -60.15 -53.21 51.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.118 179.722 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.522 HG23 ' O ' ' A' ' 86' ' ' LYS . 66.7 p -58.48 -30.57 67.1 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 120.799 0.333 . . . . 0.0 111.596 -176.173 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 41.8 m-80 -83.53 -29.56 27.79 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.492 -179.521 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 16.1 m -101.14 -0.99 35.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.711 0.291 . . . . 0.0 111.4 -175.55 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.5 tp -61.97 -21.2 25.61 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-O 120.851 0.358 . . . . 0.0 111.357 -176.65 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 9.5 t -62.64 -37.83 87.89 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.623 179.255 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -138.83 77.15 33.14 Favored Pre-proline 0 C--O 1.234 0.272 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.259 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' PRO . . . . . 0.537 ' HG2' HG22 ' A' ' 59' ' ' ILE . 72.8 Cg_endo -76.92 151.76 31.43 Favored 'Trans proline' 0 C--O 1.235 0.374 0 C-N-CA 122.649 2.232 . . . . 0.0 112.102 -178.173 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 97' ' ' THR . . . . . 0.455 HG22 ' H ' ' A' ' 98' ' ' LEU . 5.8 m -96.43 168.71 10.39 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 116.035 -0.529 . . . . 0.0 109.823 178.353 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.455 ' H ' HG22 ' A' ' 97' ' ' THR . 61.1 tp -45.79 -36.61 5.29 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 -175.275 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 99' ' ' HIS . . . . . 0.791 ' HB3' ' HB2' ' A' ' 102' ' ' ASP . 55.1 m-70 -98.13 -52.5 3.67 Favored 'General case' 0 N--CA 1.464 0.242 0 O-C-N 122.25 -0.281 . . . . 0.0 110.852 -179.255 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 33.2 t 51.5 -81.94 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.105 0.562 . . . . 0.0 112.507 174.923 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' PHE . . . . . 0.444 ' N ' ' O ' ' A' ' 99' ' ' HIS . 50.4 m-85 -74.55 -1.55 21.91 Favored 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 122.635 0.374 . . . . 0.0 111.287 -174.981 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 102' ' ' ASP . . . . . 0.791 ' HB2' ' HB3' ' A' ' 99' ' ' HIS . 8.0 t70 -51.52 -43.53 62.3 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.44 -176.205 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.33 -41.29 88.8 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 121.256 0.551 . . . . 0.0 110.373 177.269 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.09 -36.35 83.73 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.348 178.181 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.443 ' OE1' ' SG ' ' A' ' 47' ' ' CYS . 15.9 mm-40 -66.38 -36.84 83.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.449 179.583 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 52.0 m -62.06 -35.4 78.51 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.573 177.399 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' ARG . . . . . 0.514 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 0.0 OUTLIER -60.69 -49.47 77.4 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-O 121.025 0.441 . . . . 0.0 110.06 178.228 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.485 HG12 ' SD ' ' A' ' 112' ' ' MET . 96.7 t -64.28 -46.0 94.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.285 178.022 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -52.5 -47.06 66.82 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.601 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' GLN . . . . . 0.514 ' HG3' ' O ' ' A' ' 107' ' ' ARG . 0.0 OUTLIER -70.64 -31.06 67.85 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 121.139 -0.224 . . . . 0.0 110.773 -176.077 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 95.2 mt -62.58 -49.0 77.0 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.482 0.658 . . . . 0.0 109.339 172.831 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 112' ' ' MET . . . . . 0.485 ' SD ' HG12 ' A' ' 108' ' ' VAL . 66.0 mtp -60.42 -38.17 83.21 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.296 178.811 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 113' ' ' GLU . . . . . 0.613 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 39.7 tt0 -61.23 -65.72 0.65 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.718 -178.825 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 114' ' ' GLN . . . . . 0.405 ' HG2' ' O ' ' A' ' 110' ' ' GLN . 4.9 pt20 -60.93 -32.34 71.84 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.861 -174.426 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -90.4 -70.29 0.68 Allowed 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 -177.714 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 4.7 p -86.28 -25.01 25.72 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 -169.115 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 117' ' ' TYR . . . . . 0.613 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 38.2 t80 -71.55 -41.08 69.55 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 118.398 0.545 . . . . 0.0 110.659 -178.407 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 31.6 p -60.35 -51.99 67.17 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 121.321 0.581 . . . . 0.0 110.141 176.799 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 43.2 mtm-85 -59.03 -36.04 74.31 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.445 177.434 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 65.7 t80 -62.78 -38.09 89.25 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.616 177.442 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 82.5 mt -65.35 -27.22 68.43 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.788 0.327 . . . . 0.0 110.641 178.583 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 122' ' ' LYS . . . . . 0.783 ' HE2' ' HA ' ' A' ' 122' ' ' LYS . 10.4 mmpt? -102.6 1.83 35.28 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.784 178.729 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 123' ' ' SER . . . . . 0.457 ' OG ' HG22 ' A' ' 125' ' ' ILE . 79.0 p -72.96 143.16 47.74 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.749 0.309 . . . . 0.0 110.707 -179.352 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -59.99 -25.98 65.69 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.213 178.872 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.474 HD13 ' O ' ' A' ' 125' ' ' ILE . 0.0 OUTLIER -67.27 -36.64 77.27 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 177.854 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 84.0 t80 -64.61 -38.45 91.06 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 121.068 0.461 . . . . 0.0 109.913 174.696 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.528 HD13 ' HG3' ' A' ' 130' ' ' MET . 4.4 mm? -65.17 -22.59 66.93 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.751 177.027 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 128' ' ' ASP . . . . . 0.41 ' HB3' ' O ' ' A' ' 125' ' ' ILE . 24.8 t70 -73.9 -33.44 64.0 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 121.193 0.521 . . . . 0.0 109.683 173.96 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 66.9 mt -72.76 -23.38 60.81 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.796 178.09 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 130' ' ' MET . . . . . 0.528 ' HG3' HD13 ' A' ' 127' ' ' LEU . 2.4 mmt . . . . . 0 CA--C 1.529 0.163 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.954 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.2 p . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.776 0.322 . . . . 0.0 110.885 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 49.8 m -80.02 141.87 55.11 Favored Pre-proline 0 C--O 1.236 0.349 0 CA-C-N 116.148 -0.478 . . . . 0.0 109.996 176.136 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -51.39 -35.01 52.91 Favored 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 122.804 2.336 . . . . 0.0 112.898 -177.14 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.526 ' O ' ' HG2' ' A' ' 10' ' ' LYS . 14.5 mm-40 -69.0 -34.68 75.67 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.991 -179.359 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 23.4 mm-40 -71.44 -32.79 68.75 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 172.956 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.35 -42.81 98.95 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.706 178.944 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.483 HG22 ' O ' ' A' ' 6' ' ' GLU . 17.4 m -69.71 -28.31 36.79 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-O 120.98 0.419 . . . . 0.0 110.087 176.914 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.541 ' HA ' ' HG2' ' A' ' 13' ' ' GLU . 71.6 mmtt -66.56 -31.06 71.53 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.368 174.981 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.437 ' CD1' ' HG2' ' A' ' 17' ' ' LYS . 48.2 m0 -62.24 -25.75 68.0 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 173.183 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -79.85 -22.99 62.76 Favored Glycine 0 C--N 1.333 0.405 0 CA-C-N 115.565 -0.743 . . . . 0.0 112.927 -178.551 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.541 ' HG2' ' HA ' ' A' ' 10' ' ' LYS . 8.2 pt-20 -101.88 -18.07 15.89 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.821 0.31 . . . . 0.0 110.871 178.278 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 42.1 m -134.8 96.97 3.65 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.893 0.377 . . . . 0.0 111.519 -177.779 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -58.28 -34.13 70.18 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 175.781 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -54.55 -48.94 71.41 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.802 174.367 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.451 ' HD2' ' HB3' ' A' ' 10' ' ' LYS . 22.0 ttmm -67.22 -35.24 79.17 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.8 -177.494 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 67.1 tp -57.63 -49.58 75.96 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.066 -0.516 . . . . 0.0 109.924 176.453 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.5 mp -73.45 -30.26 63.08 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.966 179.748 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 26.0 t -63.73 -41.12 98.11 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.194 179.666 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 21.1 m-70 -77.49 115.88 17.61 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 175.886 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.411 ' HD2' ' N ' ' A' ' 22' ' ' ARG . 8.3 mpt_? -53.15 -35.26 59.56 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 120.86 0.362 . . . . 0.0 110.667 -177.852 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -66.25 -42.99 87.76 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.378 177.521 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -65.68 -50.51 53.66 Favored Glycine 0 C--N 1.335 0.483 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.877 179.583 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 11.5 tp -47.83 -51.59 22.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.367 0.603 . . . . 0.0 110.584 174.514 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.505 ' O ' ' HG3' ' A' ' 30' ' ' ARG . 12.8 tp10 -65.03 -40.25 94.56 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.77 -176.7 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.07 -41.76 98.5 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.046 0.451 . . . . 0.0 110.629 178.281 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 83.5 t80 -71.71 -45.57 61.4 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.152 -176.201 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.635 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 9.0 t -60.79 -45.27 95.05 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 120.937 -0.305 . . . . 0.0 110.399 -177.788 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.505 ' HG3' ' O ' ' A' ' 26' ' ' GLU . 73.8 mtt-85 -58.92 -40.48 84.67 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.017 0.437 . . . . 0.0 109.988 178.361 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.525 ' O ' HG22 ' A' ' 34' ' ' THR . 94.5 t80 -63.92 -30.88 71.93 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.479 177.549 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.482 HD23 HG22 ' A' ' 41' ' ' ILE . 18.9 tp -85.72 -20.11 29.82 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.464 -179.028 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.635 ' HG3' ' O ' ' A' ' 29' ' ' THR . 66.1 mttm -77.6 -36.14 52.11 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.018 178.951 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.525 HG22 ' O ' ' A' ' 31' ' ' PHE . 14.8 t -63.81 -29.96 71.1 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 120.884 0.373 . . . . 0.0 110.972 -177.919 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -91.99 2.77 56.34 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.412 177.928 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 89.9 m-85 55.96 47.22 20.41 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.318 179.176 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 20.3 t -131.17 15.17 5.14 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.466 176.188 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.428 ' HB2' ' OE1' ' A' ' 42' ' ' GLU . 0.1 OUTLIER -57.16 -24.25 53.06 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 115.172 -0.922 . . . . 0.0 111.199 -179.374 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.453 ' O ' ' HB2' ' A' ' 43' ' ' PHE . 11.4 pt-20 -40.13 -36.06 0.46 Allowed 'General case' 0 C--O 1.225 -0.236 0 CA-C-N 115.205 -0.907 . . . . 0.0 112.161 178.442 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.456 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 46.5 m-80 -66.95 -62.17 1.57 Allowed 'General case' 0 C--O 1.245 0.816 0 CA-C-O 121.07 0.462 . . . . 0.0 111.528 -176.833 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.521 HD13 ' HB ' ' A' ' 29' ' ' THR . 13.1 tt -62.43 -44.09 98.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.194 -176.608 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.428 ' OE1' ' HB2' ' A' ' 38' ' ' GLU . 0.9 OUTLIER -63.17 -31.5 72.66 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.071 177.365 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.456 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 76.3 t80 -55.93 -60.77 2.99 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 120.706 0.288 . . . . 0.0 110.828 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.51 ' HB2' ' HG3' ' A' ' 105' ' ' GLN . 28.6 p-90 -78.05 -11.16 59.89 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 119.722 -0.791 . . . . 0.0 111.929 -176.15 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.481 HG13 ' O ' ' A' ' 41' ' ' ILE . 54.2 mt -68.66 -39.68 80.68 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 168.2 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.55 -32.37 73.99 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.898 174.157 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.413 ' O ' ' HB3' ' A' ' 50' ' ' PHE . 43.4 t -66.54 -28.78 68.81 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.583 175.792 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.521 ' O ' ' HG3' ' A' ' 51' ' ' LYS . 4.3 tm-20 -72.81 -40.08 66.13 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 177.134 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -65.04 -33.75 76.79 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.821 174.575 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' PHE . . . . . 0.413 ' HB3' ' O ' ' A' ' 47' ' ' CYS . 74.0 t80 -60.67 -58.73 7.23 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.901 177.017 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.521 ' HG3' ' O ' ' A' ' 48' ' ' GLU . 0.0 OUTLIER -63.29 -20.75 65.76 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 116.615 -0.266 . . . . 0.0 111.491 -179.139 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -72.05 -26.81 62.33 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.893 0.378 . . . . 0.0 110.685 177.216 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 42.7 m -66.65 106.86 1.93 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.996 -177.124 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.24 -4.84 56.95 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.929 179.788 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -80.43 117.04 4.37 Favored Glycine 0 CA--C 1.52 0.373 0 N-CA-C 111.529 -0.628 . . . . 0.0 111.529 175.775 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -50.82 -46.53 29.86 Favored 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 122.921 2.414 . . . . 0.0 112.687 -177.191 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 7.3 pm0 -71.57 -33.2 68.89 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.037 0.446 . . . . 0.0 109.946 179.562 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -62.2 -36.62 82.47 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.981 -177.962 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ILE . . . . . 0.434 HG22 ' HG2' ' A' ' 96' ' ' PRO . 71.5 mt -53.89 -43.62 57.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.471 176.789 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 77.9 m80 -63.66 -43.88 95.43 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.192 178.784 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 53.6 mt -64.59 -49.37 71.4 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.138 -175.985 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -56.48 -50.87 70.5 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.205 179.151 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.97 -41.64 98.24 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.049 -179.686 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 50.5 tptt -59.53 -45.33 92.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.463 -179.534 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.18 -56.18 21.26 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.636 179.099 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 71.0 mt -57.67 -37.08 57.18 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.481 -179.461 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.457 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 86.1 t80 -58.38 -60.82 3.19 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.54 -179.446 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -82.87 -1.05 50.99 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.911 -171.936 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 57.5 tptt -105.82 -31.76 8.69 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.748 -0.206 . . . . 0.0 111.008 178.238 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 81.2 m-85 -130.01 -43.5 1.2 Allowed 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 -172.242 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.457 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 48.2 mm -77.93 -32.88 17.92 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 CA-C-O 121.046 0.451 . . . . 0.0 111.711 -173.477 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.546 ' HB3' ' HB2' ' A' ' 75' ' ' ALA . 7.0 tp60 -77.02 144.49 38.62 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.196 -173.824 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 89.4 m -71.64 -34.98 70.24 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.826 -178.37 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ASP . . . . . 0.407 ' H ' ' HG3' ' A' ' 72' ' ' GLN . 3.1 p30 -87.73 10.58 17.82 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 120.91 0.386 . . . . 0.0 110.747 177.21 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.546 ' HB2' ' HB3' ' A' ' 72' ' ' GLN . . . -69.91 154.11 94.93 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.528 179.15 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -55.18 -28.69 62.66 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.668 2.245 . . . . 0.0 112.25 178.536 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 17.9 tppt? -107.3 -69.51 0.84 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.488 -178.095 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 63.07 108.17 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.273 0.559 . . . . 0.0 110.023 -170.48 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 48.9 t -93.9 155.61 3.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.357 -176.515 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.486 ' HB2' HD21 ' A' ' 111' ' ' LEU . 45.0 m-80 -78.02 48.45 0.72 Allowed 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.238 0.542 . . . . 0.0 110.8 -179.746 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.416 HD11 HG21 ' A' ' 85' ' ' THR . 23.4 tp -79.45 151.7 30.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.382 179.291 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -53.88 137.53 38.54 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.827 -179.815 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 28.8 p90 -59.02 -45.75 89.94 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.438 -176.893 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 83.3 t60 -69.9 -30.83 68.36 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.764 0.316 . . . . 0.0 110.675 -176.662 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.416 HG21 HD11 ' A' ' 81' ' ' LEU . 39.3 m -64.8 -50.28 67.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.434 179.484 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.426 ' O ' HG23 ' A' ' 90' ' ' THR . 16.0 ptpt -71.66 -24.1 61.79 Favored 'General case' 0 CA--C 1.527 0.077 0 C-N-CA 120.76 -0.376 . . . . 0.0 110.713 -179.568 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -55.52 -53.88 50.83 Favored 'General case' 0 N--CA 1.462 0.161 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 173.512 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 53.1 t -56.77 -45.61 83.03 Favored 'Isoleucine or valine' 0 C--O 1.234 0.254 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.328 178.016 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 71.9 mt -59.4 -47.64 89.92 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.21 -178.527 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.426 HG23 ' O ' ' A' ' 86' ' ' LYS . 66.6 p -62.83 -27.06 69.06 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 120.867 0.365 . . . . 0.0 111.052 -178.173 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 82.3 m-20 -90.87 -14.2 32.21 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.459 -179.033 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 14.4 m -118.04 -0.01 11.74 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 111.804 0.298 . . . . 0.0 111.804 -176.071 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 7.8 tp -59.9 -23.26 26.19 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 CA-C-O 120.802 0.334 . . . . 0.0 111.337 -177.949 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' THR . . . . . 0.569 HG23 ' HG2' ' A' ' 95' ' ' GLN . 5.9 t -59.79 -32.71 70.86 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.855 178.749 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.569 ' HG2' HG23 ' A' ' 94' ' ' THR . 11.7 pt20 -165.05 93.02 0.92 Allowed Pre-proline 0 CA--C 1.533 0.32 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.051 177.443 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 96' ' ' PRO . . . . . 0.434 ' HG2' HG22 ' A' ' 59' ' ' ILE . 94.2 Cg_endo -81.8 158.24 18.61 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.82 2.347 . . . . 0.0 112.594 -178.719 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 25.0 p -84.28 173.83 10.66 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.955 177.725 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' LEU . . . . . 0.488 ' H ' HD22 ' A' ' 98' ' ' LEU . 3.4 mm? -49.62 -43.77 46.85 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 123.208 0.603 . . . . 0.0 112.485 -172.87 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 -129.11 28.74 5.25 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.208 -173.588 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 6.3 p -46.09 -36.15 5.56 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 112.967 0.729 . . . . 0.0 112.967 -173.685 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -82.06 18.81 1.26 Allowed 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -177.84 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -70.64 -37.76 73.78 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 121.13 0.49 . . . . 0.0 109.899 179.028 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' ALA . . . . . 0.439 ' O ' ' HG2' ' A' ' 107' ' ' ARG . . . -61.72 -46.04 91.38 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.724 175.448 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.28 -40.99 96.16 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.493 178.278 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.51 ' HG3' ' HB2' ' A' ' 44' ' ' TRP . 26.2 tt0 -57.83 -45.82 85.63 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.621 177.663 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 18.5 m -63.27 -43.64 97.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.83 -179.797 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 107' ' ' ARG . . . . . 0.439 ' HG2' ' O ' ' A' ' 103' ' ' ALA . 20.5 mmt180 -58.14 -53.51 57.49 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.917 179.207 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.437 ' O ' ' SD ' ' A' ' 112' ' ' MET . 99.5 t -69.11 -35.9 70.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.457 -175.794 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 109' ' ' TYR . . . . . 0.41 ' HA ' ' HE1' ' A' ' 112' ' ' MET . 67.7 t80 -53.8 -54.55 36.72 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.031 0.444 . . . . 0.0 110.826 179.092 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 26.6 pt20 -73.85 -20.15 60.52 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.829 179.235 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 111' ' ' LEU . . . . . 0.486 HD21 ' HB2' ' A' ' 80' ' ' ASN . 35.6 tp -61.58 -49.66 75.74 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.257 -176.814 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 112' ' ' MET . . . . . 0.505 ' HE3' ' HE1' ' A' ' 44' ' ' TRP . 0.0 OUTLIER -83.5 -29.63 27.81 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 120.312 -0.555 . . . . 0.0 110.263 177.529 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 113' ' ' GLU . . . . . 0.644 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 40.1 tt0 -52.36 -53.38 45.49 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 120.936 0.398 . . . . 0.0 110.721 179.188 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 114' ' ' GLN . . . . . 0.412 ' HG2' ' O ' ' A' ' 111' ' ' LEU . 29.8 pt20 -52.58 -18.95 1.98 Allowed 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 113.623 0.971 . . . . 0.0 113.623 -170.638 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 115' ' ' ASP . . . . . 0.583 ' O ' ' HG3' ' A' ' 119' ' ' ARG . 35.5 t70 -141.84 -52.86 0.43 Allowed 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 118.087 0.403 . . . . 0.0 111.68 -178.715 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 22.6 m -59.83 -31.76 70.03 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 120.665 0.269 . . . . 0.0 111.252 -178.801 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 117' ' ' TYR . . . . . 0.644 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 16.1 t80 -71.4 -42.75 67.94 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-O 120.647 0.261 . . . . 0.0 110.451 179.795 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 7.8 p -65.99 -35.54 80.87 Favored 'General case' 0 C--O 1.24 0.585 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.635 178.509 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 119' ' ' ARG . . . . . 0.583 ' HG3' ' O ' ' A' ' 115' ' ' ASP . 95.4 mtt180 -54.42 -51.13 65.9 Favored 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 172.266 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 79.6 t80 -58.39 -38.67 77.78 Favored 'General case' 0 C--O 1.225 -0.211 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.42 179.257 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 68.4 mt -62.95 -23.34 67.36 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.595 -179.272 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 2.4 tppp? -118.69 12.27 13.01 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.099 0.476 . . . . 0.0 111.311 177.981 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 95.2 p -71.17 146.81 48.88 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 176.245 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -56.48 -30.39 62.88 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 176.752 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 125' ' ' ILE . . . . . 0.424 ' O ' ' HG ' ' A' ' 129' ' ' LEU . 78.5 mt -56.94 -54.51 29.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-N 115.138 -0.937 . . . . 0.0 110.335 175.712 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 126' ' ' TYR . . . . . 0.482 ' O ' ' HG2' ' A' ' 130' ' ' MET . 75.7 t80 -64.1 -38.23 90.3 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.442 -178.888 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 92.4 mt -61.87 -36.1 80.25 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.166 177.535 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -70.6 -32.51 69.9 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.112 176.841 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 129' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' A' ' 125' ' ' ILE . 95.9 mt -72.29 -26.82 62.11 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.503 176.43 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 130' ' ' MET . . . . . 0.482 ' HG2' ' O ' ' A' ' 126' ' ' TYR . 27.2 mmt . . . . . 0 C--O 1.232 0.167 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 176.089 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' VAL . . . . . 0.49 HG21 ' CH2' ' A' ' 11' ' ' TRP . 2.6 p . . . . . 0 CA--C 1.529 0.136 0 CA-C-O 120.825 0.345 . . . . 0.0 110.973 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 34.4 m -114.6 155.75 45.65 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.645 177.117 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 80.5 Cg_exo -49.25 -37.11 39.05 Favored 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 122.91 2.407 . . . . 0.0 112.742 -178.401 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.448 ' O ' HG22 ' A' ' 9' ' ' VAL . 5.3 mp0 -64.62 -36.32 83.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.857 179.333 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.456 ' HB3' HG23 ' A' ' 3' ' ' VAL . 25.8 tp10 -68.37 -36.03 78.6 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 175.765 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.93 -41.38 91.43 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.338 179.922 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.448 HG22 ' O ' ' A' ' 6' ' ' GLU . 19.4 m -70.55 -23.24 24.19 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 CA-C-O 120.895 0.378 . . . . 0.0 110.29 178.717 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.48 ' O ' ' HD2' ' A' ' 17' ' ' LYS . 67.4 mmtt -67.13 -39.34 86.61 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-O 121.077 0.465 . . . . 0.0 109.847 171.68 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' TRP . . . . . 0.49 ' CH2' HG21 ' A' ' 3' ' ' VAL . 47.1 m0 -62.74 -27.09 69.04 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 175.075 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -72.42 -31.77 62.96 Favored Glycine 0 CA--C 1.52 0.358 0 CA-C-N 115.392 -0.822 . . . . 0.0 112.911 178.921 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' A' ' 10' ' ' LYS . 11.5 pt-20 -82.56 -23.11 34.65 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 117.147 0.474 . . . . 0.0 111.162 -178.941 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.522 ' HB2' ' HG2' ' A' ' 17' ' ' LYS . 49.8 m -152.22 107.68 3.3 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -179.619 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' PHE . . . . . 0.474 ' CD1' HD23 ' A' ' 18' ' ' LEU . 40.2 t80 -53.65 -27.42 27.3 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.55 175.49 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -59.2 -54.11 50.61 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.328 177.43 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.522 ' HG2' ' HB2' ' A' ' 14' ' ' SER . 17.7 ptpt -71.56 -20.08 62.07 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 120.937 -0.305 . . . . 0.0 110.599 -175.121 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.476 ' O ' ' HA3' ' A' ' 24' ' ' GLY . 48.9 tp -59.01 -48.95 79.75 Favored 'General case' 0 N--CA 1.463 0.183 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 169.656 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.503 HD23 ' CZ2' ' A' ' 44' ' ' TRP . 0.8 OUTLIER -77.44 -27.52 52.22 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.948 -179.539 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.5 ' HB3' ' HA ' ' A' ' 17' ' ' LYS . 9.7 t -74.61 -25.08 59.01 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.508 -178.125 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -92.15 126.79 37.38 Favored 'General case' 0 C--O 1.232 0.179 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 177.784 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 36.2 ttm180 -51.6 -39.71 58.49 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 120.739 0.304 . . . . 0.0 110.569 179.355 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -61.73 -40.55 95.47 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.051 179.212 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.476 ' HA3' ' O ' ' A' ' 18' ' ' LEU . . . -68.11 -48.94 50.43 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.855 -0.688 . . . . 0.0 111.517 -179.416 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 7.8 tt -58.23 -38.66 77.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.025 0.441 . . . . 0.0 110.07 174.987 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -61.22 -51.71 67.82 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.379 179.234 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -68.73 -32.95 73.1 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.916 179.468 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -73.73 -37.59 65.05 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.951 -176.284 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.457 ' O ' ' HB2' ' A' ' 33' ' ' LYS . 11.2 t -71.23 -44.39 65.43 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 121.027 -0.269 . . . . 0.0 110.58 -178.816 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 11.8 ptm180 -64.71 -32.73 74.53 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 120.847 0.356 . . . . 0.0 110.39 178.842 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 85.7 t80 -70.29 -55.73 8.48 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.205 177.338 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.443 HD23 ' HA ' ' A' ' 38' ' ' GLU . 25.5 tp -67.02 -16.5 64.4 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.996 -176.877 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.457 ' HB2' ' O ' ' A' ' 29' ' ' THR . 22.3 ttmm -69.6 -18.82 63.65 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.699 178.944 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 13.9 t -56.61 -26.32 55.35 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.038 0.447 . . . . 0.0 111.215 -179.145 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -124.59 8.12 8.28 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.39 179.376 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 53.37 41.22 32.14 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.583 176.761 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 50.5 m -107.49 20.51 18.8 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.937 179.551 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.443 ' HA ' HD23 ' A' ' 32' ' ' LEU . 6.6 pt-20 -69.3 -6.94 32.73 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.035 178.684 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -42.73 -38.4 2.07 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.049 171.113 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' ASN . . . . . 0.529 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 50.0 m-80 -64.75 -57.83 7.89 Favored 'General case' 0 C--O 1.245 0.831 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.568 -176.117 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.432 ' O ' HG13 ' A' ' 45' ' ' ILE . 9.8 tt -60.9 -41.05 87.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.13 -0.486 . . . . 0.0 109.822 -177.85 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.529 ' HA ' ' HB ' ' A' ' 45' ' ' ILE . 53.7 mt-10 -67.14 -30.14 70.05 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.859 178.213 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.529 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 81.4 t80 -54.49 -60.71 2.99 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.559 179.16 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' TRP . . . . . 0.626 ' HA ' ' SG ' ' A' ' 47' ' ' CYS . 26.4 p-90 -79.8 -14.51 58.64 Favored 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 119.357 -0.937 . . . . 0.0 111.614 -178.645 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ILE . . . . . 0.529 ' HB ' ' HA ' ' A' ' 42' ' ' GLU . 18.4 mt -62.99 -38.72 82.75 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 168.612 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.93 -36.27 82.91 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.872 174.226 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.626 ' SG ' ' HA ' ' A' ' 44' ' ' TRP . 64.3 m -61.51 -31.08 71.06 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.726 176.566 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.501 ' HG2' ' O ' ' A' ' 44' ' ' TRP . 9.2 mm-40 -73.82 -38.21 64.62 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 120.968 0.413 . . . . 0.0 109.899 176.398 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -57.74 -35.95 71.4 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.409 0.623 . . . . 0.0 109.9 174.446 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 51.0 t80 -72.46 -45.28 60.23 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 114.862 -1.063 . . . . 0.0 110.398 174.371 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.464 ' HB3' ' HA ' ' A' ' 48' ' ' GLU . 4.1 tmtm? -54.73 -38.27 66.92 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.635 -0.711 . . . . 0.0 112.502 -176.631 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 22.9 pttm -72.74 -21.19 61.06 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.043 0.449 . . . . 0.0 110.792 -176.318 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 22.7 m -81.46 75.79 8.41 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.187 -177.427 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.88 -5.99 42.03 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.943 -176.07 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -73.65 125.96 9.55 Favored Glycine 0 CA--C 1.521 0.414 0 C-N-CA 121.142 -0.552 . . . . 0.0 112.258 177.986 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_exo -48.0 -46.53 21.75 Favored 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 123.037 2.491 . . . . 0.0 112.84 -177.201 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -63.12 -42.3 99.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.625 -179.325 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -64.08 -36.7 84.88 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.578 -177.515 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 30.6 mm -51.96 -55.92 7.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.298 179.111 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 71.8 m80 -62.89 -38.76 92.18 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.947 -175.701 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 88.6 mt -69.16 -55.16 11.49 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.012 -178.069 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.478 ' HA ' ' HE2' ' A' ' 62' ' ' LYS . 7.4 mmpt? -59.83 -40.09 87.31 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.013 -178.201 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.12 -46.86 84.85 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.771 178.81 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 4.2 tppp? -66.04 -32.2 73.54 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.79 -179.63 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.03 -59.16 5.49 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 120.945 0.403 . . . . 0.0 110.25 177.565 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 65.5 mt -59.52 -35.19 57.62 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.331 178.315 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.403 ' CE1' HG22 ' A' ' 90' ' ' THR . 77.2 t80 -54.17 -63.22 1.22 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.944 -179.713 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -79.35 -9.6 59.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 0.0 112.185 -172.787 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 56.1 tptt -98.02 -33.34 11.22 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 111.627 0.232 . . . . 0.0 111.627 -179.743 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 69.9 m-85 -128.05 -43.86 1.48 Allowed 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -173.34 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 49.6 mm -67.82 -40.49 83.75 Favored 'Isoleucine or valine' 0 C--O 1.238 0.468 0 CA-C-O 120.912 0.387 . . . . 0.0 111.185 -173.853 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' GLN . . . . . 0.596 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . 15.8 mm100 -60.59 141.53 56.55 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.541 178.119 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 92.4 m -67.13 -53.25 32.36 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.543 -179.477 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -88.95 27.9 1.27 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.631 -179.506 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.596 ' HB2' ' HB2' ' A' ' 72' ' ' GLN . . . -62.28 160.04 35.27 Favored Pre-proline 0 CA--C 1.531 0.247 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.0 178.358 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -72.19 48.05 1.14 Allowed 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 123.136 2.557 . . . . 0.0 112.48 176.249 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -178.92 -59.0 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 178.07 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 69.86 126.48 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.756 -177.439 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 57.8 t -121.04 138.2 52.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.422 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.935 177.189 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 37.1 m-80 -75.08 86.05 2.35 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.509 0.671 . . . . 0.0 111.075 179.567 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 15.1 tp -125.58 151.92 45.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.102 -0.953 . . . . 0.0 109.974 178.395 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -57.49 135.37 56.61 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.397 179.293 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 81.6 m-85 -67.68 -42.65 81.75 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.06 -175.982 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 72.7 t60 -58.62 -31.89 68.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.965 0.412 . . . . 0.0 110.381 178.285 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 37.7 m -66.97 -46.54 74.32 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.741 178.346 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -69.68 -24.99 63.67 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.226 -179.419 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -59.24 -52.41 65.79 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.392 0.615 . . . . 0.0 109.892 174.504 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 91.6 t -59.52 -39.28 78.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.027 177.931 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 81.5 mt -63.41 -43.8 98.65 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.04 179.107 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' THR . . . . . 0.403 HG22 ' CE1' ' A' ' 67' ' ' TYR . 33.7 p -65.09 -23.68 67.23 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-O 120.828 0.347 . . . . 0.0 111.097 -178.965 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 39.2 m-80 -86.92 -21.76 26.09 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.897 176.065 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 28.2 t -99.35 -9.49 23.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.29 -177.345 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.4 tp -58.16 -26.29 29.03 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 CA-C-O 120.783 0.325 . . . . 0.0 111.665 -175.771 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 6.0 t -62.95 -44.59 95.66 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.103 -179.835 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -148.62 79.9 8.52 Favored Pre-proline 0 N--CA 1.464 0.225 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 179.853 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -84.73 155.11 11.76 Favored 'Trans proline' 0 N--CA 1.46 -0.454 0 C-N-CA 122.579 2.186 . . . . 0.0 112.104 179.164 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 25.2 p -89.63 169.67 11.12 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.387 175.675 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 9.0 mp -53.28 -27.79 24.57 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 122.818 0.447 . . . . 0.0 112.043 -175.396 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' HIS . . . . . 0.463 ' HD2' ' HB2' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -131.02 44.01 3.02 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.101 0.477 . . . . 0.0 110.118 177.224 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 34.7 t -57.49 -34.47 69.08 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.471 176.68 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 85.7 m-85 -81.88 14.68 2.59 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.367 -178.322 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' ASP . . . . . 0.414 ' HB2' ' O ' ' A' ' 99' ' ' HIS . 12.8 t70 -57.83 -44.2 86.32 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 120.831 0.348 . . . . 0.0 110.537 -178.725 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.34 -43.05 96.82 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 121.06 0.457 . . . . 0.0 110.751 177.511 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.68 -37.85 88.92 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.168 178.888 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' GLN . . . . . 0.611 HE21 ' HB2' ' A' ' 44' ' ' TRP . 34.3 tt0 -63.7 -45.05 91.74 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.137 178.232 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 36.5 m -57.74 -47.19 83.17 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.358 177.611 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 23.0 mmt180 -52.71 -62.66 1.51 Allowed 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.947 178.297 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 108' ' ' VAL . . . . . 0.436 HG13 ' HB3' ' A' ' 40' ' ' ASN . 80.8 t -60.23 -42.6 90.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.449 -176.118 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 49.9 t80 -56.44 -51.88 66.74 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.095 -178.246 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 5.2 pp0? -73.45 -23.9 60.16 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 116.785 -0.189 . . . . 0.0 111.427 -176.87 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 61.7 mt -67.61 -49.14 64.5 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.82 0.343 . . . . 0.0 110.235 175.637 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 49.7 mtm -64.34 -36.48 84.27 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 116.158 -0.474 . . . . 0.0 109.886 178.061 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 113' ' ' GLU . . . . . 0.595 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 44.7 tt0 -55.74 -65.69 0.55 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.631 179.64 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -62.0 -15.64 45.64 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 113.034 0.753 . . . . 0.0 113.034 -171.938 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -121.84 -61.95 1.45 Allowed 'General case' 0 N--CA 1.466 0.33 0 O-C-N 121.979 -0.45 . . . . 0.0 112.059 -176.002 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 2.6 m -68.74 -39.09 80.5 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.886 -177.018 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 117' ' ' TYR . . . . . 0.595 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 36.1 t80 -78.24 -37.81 44.42 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.986 -173.831 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 21.1 p -61.05 -48.94 79.4 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.219 0.533 . . . . 0.0 110.111 176.342 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 65.5 mtm180 -64.62 -34.33 78.02 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.39 176.236 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -61.27 -37.6 83.75 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.623 177.692 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.416 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 95.4 mt -63.66 -44.93 92.34 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.203 0.525 . . . . 0.0 110.606 177.546 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 23.0 tptp -92.13 5.02 51.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.696 -174.016 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 85.3 p -69.09 141.19 54.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.786 0.327 . . . . 0.0 110.918 178.84 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -56.07 -32.7 64.34 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.042 177.202 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -65.76 -36.86 78.58 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.237 179.592 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -74.44 -38.0 63.12 Favored 'General case' 0 C--O 1.233 0.192 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 177.059 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 95.8 mt -61.75 -28.43 69.43 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.972 175.836 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -69.4 -41.7 76.08 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.086 173.585 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 98.1 mt -63.41 -25.68 68.39 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.569 178.302 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 130' ' ' MET . . . . . . . . . . . . . 28.8 mmt . . . . . 0 C--N 1.33 -0.24 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.247 175.249 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 49.4 m . . . . . 0 N--CA 1.476 0.865 0 N-CA-C 110.266 -0.272 . . . . 0.0 110.266 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 56.5 ttp -64.69 106.0 1.1 Allowed 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -174.604 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 2.9 p -137.21 139.49 43.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.275 175.292 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.1 m -96.19 149.89 36.49 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.046 178.05 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -51.0 -35.54 50.65 Favored 'Trans proline' 0 C--N 1.352 0.715 0 C-N-CA 122.88 2.387 . . . . 0.0 112.364 -179.178 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.53 ' O ' HG22 ' A' ' 9' ' ' VAL . 34.4 tt0 -59.78 -52.0 67.35 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.06 0.457 . . . . 0.0 110.408 176.678 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 32.8 tp10 -56.49 -39.22 72.91 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.641 177.604 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.96 -46.02 86.5 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 115.758 -0.656 . . . . 0.0 111.731 -179.075 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.53 HG22 ' O ' ' A' ' 6' ' ' GLU . 24.7 m -67.16 -28.32 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 CA-C-O 120.931 0.396 . . . . 0.0 110.229 -179.862 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -70.7 -32.05 69.13 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.227 175.725 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 53.2 m0 -66.4 -21.88 66.23 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 173.747 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -83.17 2.15 87.48 Favored Glycine 0 C--N 1.335 0.495 0 CA-C-N 115.707 -0.678 . . . . 0.0 112.915 -179.45 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -125.51 -41.33 2.02 Favored 'General case' 0 C--O 1.234 0.274 0 O-C-N 122.803 -0.234 . . . . 0.0 110.532 176.588 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.435 ' HB2' ' HB3' ' A' ' 17' ' ' LYS . 14.0 m -108.74 101.92 11.01 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 120.842 0.353 . . . . 0.0 110.983 -178.758 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -61.95 -39.7 93.02 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.459 -178.612 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -64.7 -31.63 72.94 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.525 178.826 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.435 ' HB3' ' HB2' ' A' ' 14' ' ' SER . 62.5 tttp -70.5 -35.07 73.01 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 179.633 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.4 tp -62.15 -48.0 82.03 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.025 173.568 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.408 ' O ' ' HB2' ' A' ' 25' ' ' LEU . 60.2 tp -65.93 -49.07 69.26 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.624 -177.831 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 44.1 m -67.33 -29.43 69.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.788 -173.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -76.67 119.78 20.95 Favored 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 179.539 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -51.61 -39.19 57.54 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 121.088 0.471 . . . . 0.0 110.632 -176.87 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -66.78 -38.33 86.33 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.12 -179.748 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -71.95 -50.17 19.44 Favored Glycine 0 C--N 1.333 0.382 0 CA-C-N 115.505 -0.77 . . . . 0.0 111.955 -178.754 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.408 ' HB2' ' O ' ' A' ' 19' ' ' LEU . 7.9 tt -52.0 -43.16 63.52 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 122.787 0.435 . . . . 0.0 110.112 175.501 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.495 ' O ' ' HG3' ' A' ' 30' ' ' ARG . 13.6 tp10 -58.12 -56.07 26.79 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.466 178.179 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -60.76 -40.78 93.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.333 -177.281 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 62.8 t80 -69.71 -43.6 72.05 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.785 -175.004 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.422 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 11.6 t -67.9 -41.21 83.04 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 121.075 -0.25 . . . . 0.0 110.732 -178.466 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.495 ' HG3' ' O ' ' A' ' 26' ' ' GLU . 58.7 mtp180 -62.16 -43.22 99.33 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.974 0.416 . . . . 0.0 110.235 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.585 ' O ' HG22 ' A' ' 34' ' ' THR . 87.0 t80 -64.45 -47.13 80.22 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.978 175.816 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.459 HD23 ' HA ' ' A' ' 38' ' ' GLU . 12.2 tp -64.95 -21.83 66.9 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.86 -175.903 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.422 ' HG3' ' O ' ' A' ' 29' ' ' THR . 38.8 mttp -68.06 -29.98 69.08 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.713 178.591 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.585 HG22 ' O ' ' A' ' 31' ' ' PHE . 3.6 t -65.7 -21.93 66.58 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 120.871 0.367 . . . . 0.0 110.647 -177.208 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -118.56 7.44 11.8 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.819 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 56.2 t80 58.24 19.17 5.97 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.864 175.051 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 42.2 m -79.27 0.7 27.65 Favored 'General case' 0 C--N 1.327 -0.384 0 O-C-N 121.985 -0.447 . . . . 0.0 110.636 -178.216 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.47 ' HA ' HG22 ' A' ' 41' ' ' ILE . 7.5 pt-20 -59.26 -22.88 61.8 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.61 176.661 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -53.21 -45.98 68.85 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.665 176.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.521 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 91.7 m-20 -64.4 -52.19 59.42 Favored 'General case' 0 C--O 1.241 0.654 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.633 -177.255 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.47 HG22 ' HA ' ' A' ' 38' ' ' GLU . 13.0 tt -61.46 -44.7 99.01 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.155 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.369 -177.259 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.51 ' HA ' ' HB ' ' A' ' 45' ' ' ILE . 40.9 mt-10 -73.26 -21.19 60.66 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.101 -179.779 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.521 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 37.1 t80 -58.16 -60.5 3.66 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 120.614 0.245 . . . . 0.0 110.34 175.27 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.576 ' HB2' ' HG2' ' A' ' 105' ' ' GLN . 47.1 p-90 -75.77 -18.78 59.41 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 119.893 -0.723 . . . . 0.0 111.35 -177.667 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.51 ' HB ' ' HA ' ' A' ' 42' ' ' GLU . 41.4 mt -63.62 -41.51 92.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 169.656 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.07 -31.25 72.02 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.216 175.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.496 ' SG ' ' HA ' ' A' ' 44' ' ' TRP . 74.5 m -67.61 -32.73 73.66 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.433 176.812 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 55.0 mm-40 -71.52 -37.02 71.24 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 116.595 -0.275 . . . . 0.0 110.419 175.051 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -65.57 -36.74 84.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.422 0.629 . . . . 0.0 109.406 176.776 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.408 ' CZ ' HG23 ' A' ' 59' ' ' ILE . 50.4 t80 -62.67 -47.05 85.36 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 114.977 -1.01 . . . . 0.0 109.951 172.612 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.97 -22.72 65.88 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 115.386 -0.824 . . . . 0.0 111.163 178.405 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.433 ' HE2' ' HB3' ' A' ' 52' ' ' LYS . 32.4 ttpt -76.8 -18.45 58.41 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.916 -0.583 . . . . 0.0 111.032 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 22.6 t -66.39 159.51 26.78 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 121.11 0.481 . . . . 0.0 111.159 -176.111 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.3 15.95 2.59 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.743 179.089 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -104.13 105.77 2.66 Favored Glycine 0 CA--C 1.518 0.271 0 N-CA-C 111.096 -0.802 . . . . 0.0 111.096 177.022 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -48.58 -50.49 12.27 Favored 'Trans proline' 0 C--N 1.35 0.613 0 C-N-CA 123.017 2.478 . . . . 0.0 112.863 -176.004 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 3.6 pp0? -65.89 -34.52 78.32 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.77 0.319 . . . . 0.0 110.888 177.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -68.07 -30.22 69.36 Favored 'General case' 0 N--CA 1.461 0.112 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.934 -179.124 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.408 HG23 ' CZ ' ' A' ' 50' ' ' PHE . 40.8 mm -56.88 -43.56 80.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.199 176.424 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 26.3 m80 -69.65 -42.05 74.74 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.568 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 85.9 mt -64.01 -44.55 92.26 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.802 -179.68 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -66.79 -46.81 74.1 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.552 179.001 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.62 -40.24 91.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.223 -178.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 38.2 mmtm -65.72 -37.51 86.61 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.739 178.38 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.8 -53.95 46.41 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.089 0.471 . . . . 0.0 109.963 176.117 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.419 ' HA ' ' HD1' ' A' ' 70' ' ' PHE . 69.9 mt -59.6 -35.05 57.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.366 178.778 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.495 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 40.1 t80 -57.92 -68.13 0.27 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.215 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -67.56 -33.74 75.65 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.446 -173.375 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.488 ' HA ' ' HD2' ' A' ' 76' ' ' PRO . 88.1 tttt -86.58 -29.13 22.85 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.958 -0.565 . . . . 0.0 112.098 -172.544 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.419 ' HD1' ' HA ' ' A' ' 66' ' ' ILE . 96.1 m-85 -125.03 -53.4 1.64 Allowed 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -174.556 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.495 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 42.4 mm -64.28 -34.39 68.79 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -169.28 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.431 ' HA ' ' OE1' ' A' ' 72' ' ' GLN . 14.1 mm-40 -58.27 155.86 10.86 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.469 0.652 . . . . 0.0 111.968 -177.513 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.8 t -74.59 -28.65 61.01 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.009 179.233 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -87.51 -82.66 0.22 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.209 175.807 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . 57.19 158.66 0.08 OUTLIER Pre-proline 0 CA--C 1.542 0.636 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 174.714 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.488 ' HD2' ' HA ' ' A' ' 69' ' ' LYS . 64.2 Cg_endo -75.25 -16.34 19.72 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.31 2.006 . . . . 0.0 111.602 170.871 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -105.61 -51.81 2.93 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.418 177.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 64.51 93.59 0.06 Allowed 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.299 -175.693 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 65.5 t -86.29 141.92 13.79 Favored 'Isoleucine or valine' 0 C--O 1.237 0.443 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.759 -178.521 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 36.4 m-80 -78.14 23.41 0.28 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.42 -176.777 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 18.0 tp -65.57 142.81 57.97 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.964 177.825 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -48.57 140.11 8.52 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.64 -0.709 . . . . 0.0 112.067 -179.087 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.404 ' O ' ' HG2' ' A' ' 86' ' ' LYS . 84.3 t80 -61.1 -52.89 62.98 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.387 -176.171 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 57.3 t60 -59.43 -38.59 81.08 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.869 0.366 . . . . 0.0 110.641 -177.09 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.431 ' O ' HG13 ' A' ' 89' ' ' ILE . 41.0 m -66.25 -51.62 55.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.76 -179.372 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.558 ' O ' HG23 ' A' ' 90' ' ' THR . 18.1 ptmt -67.29 -25.61 66.13 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.594 -177.64 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -64.08 -52.45 59.25 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-O 121.479 0.657 . . . . 0.0 109.405 175.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 99.0 t -58.95 -37.01 64.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.306 177.24 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.431 HG13 ' O ' ' A' ' 85' ' ' THR . 72.8 mt -66.98 -45.04 88.05 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.222 179.365 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.558 HG23 ' O ' ' A' ' 86' ' ' LYS . 48.4 p -57.34 -26.12 60.47 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 120.987 0.423 . . . . 0.0 110.757 -178.712 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -87.8 -41.42 13.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.148 175.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 22.5 t -79.51 -0.92 35.3 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.615 -174.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.9 tp -74.57 -4.53 5.78 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 CA-C-O 120.848 0.356 . . . . 0.0 111.552 -177.294 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 4.5 t -65.11 -47.18 78.08 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 116.686 -0.234 . . . . 0.0 110.881 179.048 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -132.23 81.35 61.41 Favored Pre-proline 0 N--CA 1.466 0.369 0 CA-C-O 121.161 0.505 . . . . 0.0 110.341 175.676 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_endo -71.43 139.62 35.01 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.746 2.298 . . . . 0.0 112.734 -176.601 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.441 ' H ' ' HB3' ' A' ' 100' ' ' SER . 35.4 p -87.18 172.93 9.55 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.419 173.509 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 41.7 tp -57.79 -36.61 72.42 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 121.189 0.519 . . . . 0.0 110.778 -179.574 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' HIS . . . . . 0.523 ' HB3' ' HB3' ' A' ' 102' ' ' ASP . 46.9 m80 -113.28 38.87 2.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.12 177.174 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' SER . . . . . 0.441 ' HB3' ' H ' ' A' ' 97' ' ' THR . 9.2 p -55.39 -38.78 69.34 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.053 0.454 . . . . 0.0 111.422 -179.833 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 -93.95 21.84 6.29 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.409 -177.342 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ASP . . . . . 0.523 ' HB3' ' HB3' ' A' ' 99' ' ' HIS . 7.3 p-10 -63.99 -35.29 80.2 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 120.976 0.417 . . . . 0.0 110.192 -179.451 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.494 ' O ' ' HG2' ' A' ' 107' ' ' ARG . . . -63.42 -48.47 77.66 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.887 174.795 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -58.33 -43.1 88.07 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.505 179.276 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.576 ' HG2' ' HB2' ' A' ' 44' ' ' TRP . 0.7 OUTLIER -57.06 -53.16 61.27 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.778 178.397 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 47.4 m -58.47 -48.17 81.64 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.165 -178.793 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' ARG . . . . . 0.494 ' HG2' ' O ' ' A' ' 103' ' ' ALA . 29.9 mmt180 -56.64 -65.05 0.68 Allowed 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.958 0.409 . . . . 0.0 110.886 -178.578 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.421 ' O ' ' HG3' ' A' ' 112' ' ' MET . 63.5 t -58.46 -38.57 70.92 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.4 -174.184 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 86.8 t80 -56.52 -56.6 19.22 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.77 179.052 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.29 -12.89 60.37 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.629 -0.259 . . . . 0.0 111.237 -177.375 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 107' ' ' ARG . 53.4 mt -72.8 -45.56 57.88 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 173.266 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 112' ' ' MET . . . . . 0.421 ' HG3' ' O ' ' A' ' 108' ' ' VAL . 33.6 mtm -61.96 -34.81 76.81 Favored 'General case' 0 CA--C 1.52 -0.191 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 178.428 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' GLU . . . . . 0.564 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 3.9 tm-20 -56.81 -68.76 0.19 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.178 177.544 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -63.75 -19.43 64.95 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.866 -0.607 . . . . 0.0 112.305 -174.127 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -101.14 -71.33 0.71 Allowed 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 120.991 0.424 . . . . 0.0 111.523 -179.049 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 7.4 m -79.4 -33.54 42.64 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.068 -0.515 . . . . 0.0 112.136 -171.335 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' TYR . . . . . 0.564 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 41.4 t80 -75.24 -30.9 60.65 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.662 0.268 . . . . 0.0 110.773 -173.235 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 32.8 p -64.16 -56.21 16.38 Favored 'General case' 0 C--O 1.24 0.598 0 CA-C-O 120.991 0.424 . . . . 0.0 110.642 177.751 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 9.4 ptp85 -60.81 -32.48 71.84 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.021 177.947 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -60.77 -40.29 91.98 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.538 177.562 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 92.5 mt -71.62 -26.92 62.77 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.746 -178.318 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 16.4 tppt? -106.75 7.05 30.18 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 120.966 0.413 . . . . 0.0 111.342 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 86.9 p -74.8 156.61 36.33 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 110.249 -0.278 . . . . 0.0 110.249 178.454 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -58.74 -24.67 62.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.164 175.064 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 50.8 mm -61.92 -56.53 17.12 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.576 178.629 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 66.3 t80 -72.34 -37.75 68.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.548 -177.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 80.8 mt -63.81 -30.16 71.28 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.299 177.653 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -66.65 -38.73 87.48 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.091 174.462 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 98.8 mt -66.03 -28.59 68.98 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.301 176.069 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' MET . . . . . . . . . . . . . 26.6 mmt -79.82 -38.02 33.86 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.732 179.187 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 57.59 26.19 12.53 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.042 -177.069 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . -73.34 -93.05 0.11 Allowed Glycine 0 N--CA 1.448 -0.53 0 CA-C-N 115.712 -0.677 . . . . 0.0 112.393 -179.21 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 23.9 ptt180 -157.85 133.6 5.94 Favored Pre-proline 0 CA--C 1.531 0.249 0 CA-C-O 120.45 0.167 . . . . 0.0 111.196 -176.676 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo . . . . . 0 C--N 1.347 0.464 0 C-N-CA 122.883 2.389 . . . . 0.0 111.282 171.393 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 16.9 t . . . . . 0 N--CA 1.48 1.06 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 24.7 ptm -119.58 119.6 34.25 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.845 0.355 . . . . 0.0 110.468 178.362 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 13.3 p -83.89 155.98 3.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.35 178.183 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.7 m -66.11 135.62 95.16 Favored Pre-proline 0 CA--C 1.535 0.387 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.261 175.391 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -49.01 -29.58 16.01 Favored 'Trans proline' 0 C--N 1.354 0.864 0 C-N-CA 123.038 2.492 . . . . 0.0 112.281 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -52.61 -59.96 3.83 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.748 177.746 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.54 ' HA ' ' HB3' ' A' ' 10' ' ' LYS . 25.5 tt0 -79.82 -22.67 42.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.823 -177.614 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -56.9 -46.49 81.9 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 120.87 0.367 . . . . 0.0 110.304 176.827 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 33.7 m -76.16 -29.04 19.01 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.382 177.119 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.54 ' HB3' ' HA ' ' A' ' 7' ' ' GLU . 16.2 tppt? -65.08 -27.51 68.82 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.808 176.606 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 43.6 m0 -65.96 -27.52 68.22 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 120.682 0.277 . . . . 0.0 110.615 175.477 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -61.6 -12.55 34.23 Favored Glycine 0 CA--C 1.52 0.371 0 CA-C-N 115.728 -0.669 . . . . 0.0 114.209 -173.047 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.486 ' HG2' ' O ' ' A' ' 10' ' ' LYS . 12.0 pt-20 -104.36 -14.85 15.61 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 117.367 0.583 . . . . 0.0 111.901 -178.605 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.549 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 19.3 m -145.21 95.03 2.61 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-O 120.987 0.423 . . . . 0.0 111.901 -173.339 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.463 ' O ' ' HB3' ' A' ' 18' ' ' LEU . 15.9 t80 -54.86 -32.24 60.53 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.377 0.608 . . . . 0.0 109.884 175.122 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -57.15 -50.37 73.04 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.425 176.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.549 ' HG2' ' O ' ' A' ' 14' ' ' SER . 13.0 ptmm? -69.99 -22.86 63.09 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 120.81 -0.356 . . . . 0.0 110.081 -175.865 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.463 ' HB3' ' O ' ' A' ' 15' ' ' PHE . 62.8 tp -59.55 -54.7 43.47 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.917 174.921 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -68.44 -34.72 76.49 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.655 177.83 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.458 ' HB3' ' HA ' ' A' ' 17' ' ' LYS . 23.9 t -64.43 -25.09 67.86 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.508 179.376 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 16.2 t-80 -88.84 113.66 24.63 Favored 'General case' 0 C--O 1.223 -0.29 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 177.565 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 8.4 ptm180 -47.23 -45.27 23.38 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-O 120.782 0.325 . . . . 0.0 111.601 -176.455 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -67.59 -34.46 77.06 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.068 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -72.37 -41.67 51.67 Favored Glycine 0 C--N 1.331 0.282 0 N-CA-C 111.396 -0.682 . . . . 0.0 111.396 -179.194 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 7.3 tt -60.0 -41.85 93.0 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 174.488 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.457 ' O ' HG22 ' A' ' 29' ' ' THR . 30.2 tt0 -60.3 -55.5 32.95 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.77 176.676 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -56.75 -43.85 81.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.332 -178.301 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 80.2 t80 -68.45 -43.33 77.3 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.06 -176.766 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.457 HG22 ' O ' ' A' ' 26' ' ' GLU . 12.5 t -67.04 -35.7 80.47 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 120.665 -0.414 . . . . 0.0 110.083 -179.439 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.453 ' HG3' ' O ' ' A' ' 26' ' ' GLU . 43.4 mtp180 -64.74 -45.46 86.38 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 121.085 0.469 . . . . 0.0 109.753 176.23 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 80.1 t80 -62.43 -42.04 99.17 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.565 177.316 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.437 ' HA ' ' HB3' ' A' ' 35' ' ' GLU . 16.2 tp -75.42 -22.09 57.66 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.501 -176.438 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.531 ' HE2' ' HG3' ' A' ' 38' ' ' GLU . 1.5 mptm? -71.68 -47.26 55.36 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.013 174.31 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 14.5 t -73.46 -18.3 61.14 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 120.854 0.359 . . . . 0.0 110.085 177.538 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.437 ' HB3' ' HA ' ' A' ' 32' ' ' LEU . 10.2 tp10 -75.11 -25.05 58.2 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.318 171.445 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 33.9 t80 68.39 33.57 4.09 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.128 177.455 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.1 m -136.43 30.46 2.92 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.553 -178.738 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.531 ' HG3' ' HE2' ' A' ' 33' ' ' LYS . 0.1 OUTLIER -70.52 -11.49 60.96 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.009 -0.542 . . . . 0.0 111.193 -177.91 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -45.25 -37.32 4.58 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.275 176.372 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.621 HD21 ' HB2' ' A' ' 80' ' ' ASN . 4.4 m-20 -69.36 -50.54 45.26 Favored 'General case' 0 C--O 1.242 0.662 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.896 -178.671 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.471 HG22 ' O ' ' A' ' 38' ' ' GLU . 11.2 tt -64.83 -42.92 96.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 C-N-CA 121.021 -0.272 . . . . 0.0 110.281 -175.215 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.42 ' HA ' ' HB ' ' A' ' 45' ' ' ILE . 51.8 mt-10 -69.22 -25.36 64.27 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.433 -0.348 . . . . 0.0 110.482 178.783 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.502 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 78.1 t80 -57.54 -60.9 2.96 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.726 178.38 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.731 ' HA ' ' SG ' ' A' ' 47' ' ' CYS . 43.1 p-90 -78.78 -17.01 56.44 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 119.779 -0.769 . . . . 0.0 111.82 -178.336 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.42 ' HB ' ' HA ' ' A' ' 42' ' ' GLU . 30.7 mt -63.85 -38.51 82.53 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 168.268 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.71 -34.69 67.3 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.1 178.474 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.731 ' SG ' ' HA ' ' A' ' 44' ' ' TRP . 18.2 p -72.25 -23.67 61.25 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-O 120.562 0.22 . . . . 0.0 110.502 -179.252 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -67.97 -52.46 35.72 Favored 'General case' 0 CA--C 1.521 -0.139 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 170.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -55.92 -27.72 53.55 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.795 -0.638 . . . . 0.0 110.311 175.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.559 ' HA ' ' HD2' ' A' ' 62' ' ' LYS . 49.9 t80 -69.62 -50.35 45.23 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.991 178.052 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 64.8 pttt -72.52 -21.14 61.23 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 121.252 0.548 . . . . 0.0 110.157 178.684 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -74.68 -38.32 62.43 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.959 -176.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.8 p -63.24 128.68 36.93 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.905 0.383 . . . . 0.0 110.319 176.431 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -102.35 -1.75 30.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.206 -174.694 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -88.38 115.1 4.34 Favored Glycine 0 CA--C 1.521 0.457 0 C-N-CA 121.109 -0.567 . . . . 0.0 111.848 177.677 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -53.69 -33.84 71.45 Favored 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 122.886 2.391 . . . . 0.0 112.374 -178.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 58.2 mt-30 -65.47 -49.26 69.74 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.598 178.355 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -59.2 -38.53 80.12 Favored 'General case' 0 N--CA 1.461 0.109 0 CA-C-N 115.0 -1.0 . . . . 0.0 110.534 179.617 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.425 ' O ' ' HE1' ' A' ' 50' ' ' PHE . 43.1 mm -54.38 -53.83 26.93 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.039 178.954 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.494 ' HA ' ' HG2' ' A' ' 96' ' ' PRO . 20.0 m80 -63.39 -46.95 84.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.317 -176.325 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 88.8 mt -67.52 -44.05 79.33 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.114 -176.463 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.559 ' HD2' ' HA ' ' A' ' 50' ' ' PHE . 40.1 ttmt -64.17 -41.01 97.3 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.543 -178.819 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.26 -41.1 92.54 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.416 178.122 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 65.5 tttm -65.88 -38.06 87.79 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.128 178.597 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.18 -52.14 64.98 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.385 176.623 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 75.4 mt -59.34 -35.99 61.38 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 CA-C-O 121.257 0.551 . . . . 0.0 110.014 178.136 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 90.2 t80 -58.43 -60.95 2.99 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.58 178.448 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -70.19 -18.21 63.18 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.886 -174.795 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 85.4 tttt -97.24 -28.76 13.93 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 111.887 0.328 . . . . 0.0 111.887 -174.509 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 70.9 m-85 -130.83 -46.45 1.04 Allowed 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 -173.821 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 48.0 mm -74.51 -34.2 34.89 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 CA-C-O 121.085 0.469 . . . . 0.0 111.392 -173.296 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.414 ' OE1' ' HB3' ' A' ' 74' ' ' ASP . 0.0 OUTLIER -61.39 137.47 58.24 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.328 -174.386 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 22.9 m -66.01 -24.22 66.72 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 121.387 0.613 . . . . 0.0 109.67 174.902 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.414 ' HB3' ' OE1' ' A' ' 72' ' ' GLN . 20.8 t70 -106.05 86.26 2.34 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 169.763 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -137.95 152.49 72.25 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.122 -179.517 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_exo -46.8 -48.81 13.4 Favored 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 123.124 2.55 . . . . 0.0 112.857 -178.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.429 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 94.0 mttt -116.32 -37.0 3.86 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.219 178.755 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.429 ' HB2' ' O ' ' A' ' 77' ' ' LYS . 44.0 mt-10 66.49 -177.47 0.2 Allowed 'General case' 0 C--O 1.234 0.279 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 -164.024 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.429 HG21 ' HD1' ' A' ' 43' ' ' PHE . 69.4 t -144.32 141.17 24.39 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 N-CA-C 110.339 -0.245 . . . . 0.0 110.339 177.463 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.621 ' HB2' HD21 ' A' ' 40' ' ' ASN . 34.7 m-80 -64.66 80.91 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.049 176.942 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 36.6 tp -127.5 143.73 51.15 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.432 -0.803 . . . . 0.0 109.741 179.011 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -50.38 132.2 24.62 Favored 'General case' 0 N--CA 1.466 0.371 0 O-C-N 123.427 0.454 . . . . 0.0 111.193 177.84 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -62.55 -38.2 89.13 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.911 -177.433 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.468 ' O ' HG23 ' A' ' 88' ' ' VAL . 84.7 t60 -65.41 -36.94 85.47 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 179.005 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 48.3 m -66.38 -41.39 89.46 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.127 175.894 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -60.95 -41.37 96.18 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 175.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -57.66 -44.1 85.46 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.656 178.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.468 HG23 ' O ' ' A' ' 84' ' ' HIS . 99.4 t -56.93 -44.74 82.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.114 176.203 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 71.8 mt -70.23 -38.19 73.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.321 -177.224 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 41.7 p -65.05 -26.67 68.35 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 120.682 0.277 . . . . 0.0 111.063 -177.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 47.8 m-80 -86.31 -46.05 10.67 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.897 175.79 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 21.8 m -82.01 -3.61 54.88 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 -173.72 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 7.9 tp -56.38 -23.07 15.82 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 CA-C-O 120.975 0.417 . . . . 0.0 111.342 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 11.6 t -64.1 -33.64 76.22 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.417 -179.081 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 17.2 mm-40 -140.5 76.64 24.72 Favored Pre-proline 0 N--CA 1.466 0.34 0 CA-C-O 120.748 0.309 . . . . 0.0 110.251 -178.864 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.494 ' HG2' ' HA ' ' A' ' 60' ' ' HIS . 72.0 Cg_endo -76.97 138.26 18.26 Favored 'Trans proline' 0 CA--C 1.531 0.371 0 C-N-CA 122.538 2.159 . . . . 0.0 112.085 179.776 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 5.8 m -105.82 162.72 13.3 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.422 -179.091 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.567 ' H ' HD22 ' A' ' 98' ' ' LEU . 3.9 mm? -15.75 -57.87 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 125.037 1.335 . . . . 0.0 114.006 -177.962 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 16.2 t-80 -146.23 35.83 1.0 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.874 -1.057 . . . . 0.0 109.593 -163.25 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 25.0 t -61.0 -10.99 6.68 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 114.973 -1.012 . . . . 0.0 112.071 -175.81 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 81.6 m-85 -87.34 14.64 7.59 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.805 -0.179 . . . . 0.0 111.221 178.289 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -59.01 -44.53 91.71 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 120.823 0.344 . . . . 0.0 110.811 -179.33 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.91 -42.07 97.33 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 121.221 0.534 . . . . 0.0 110.379 177.905 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.54 -39.34 91.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.631 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -60.47 -44.23 96.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.216 178.908 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 36.6 t -58.93 -52.12 67.1 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.326 178.191 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' ARG . . . . . 0.441 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 19.4 mmt180 -54.54 -61.37 2.35 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.159 -179.573 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.447 HG21 ' CD2' ' A' ' 43' ' ' PHE . 59.2 t -57.94 -46.43 87.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.569 -0.742 . . . . 0.0 112.052 -173.785 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 68.3 t80 -57.71 -52.72 64.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.983 -178.384 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.441 ' HG3' ' O ' ' A' ' 107' ' ' ARG . 4.7 pp0? -71.93 -31.76 66.67 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.929 0.395 . . . . 0.0 110.887 -176.381 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 31.9 tp -68.94 -38.5 79.53 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.952 -175.109 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' MET . . . . . 0.483 ' HB3' HD22 ' A' ' 40' ' ' ASN . 24.4 ptt? -82.4 -22.25 35.46 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 176.709 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 113' ' ' GLU . . . . . 0.689 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 37.2 tt0 -61.82 -59.61 4.88 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.141 178.27 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -49.14 -35.42 16.52 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.195 -176.816 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -104.92 -65.93 1.01 Allowed 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 -175.463 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 33.3 t -63.92 -36.57 84.38 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 111.698 0.258 . . . . 0.0 111.698 -173.139 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' TYR . . . . . 0.689 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 15.5 t80 -70.0 -40.23 75.41 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 120.453 0.168 . . . . 0.0 110.925 -177.867 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 28.8 p -65.63 -44.26 87.01 Favored 'General case' 0 C--O 1.241 0.648 0 CA-C-O 121.186 0.517 . . . . 0.0 109.966 176.27 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 75.1 mtp85 -57.24 -40.15 77.01 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.077 174.892 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -61.43 -40.76 95.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.095 176.81 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 89.8 mt -68.88 -8.96 48.88 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.202 179.286 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 122' ' ' LYS . . . . . 0.463 ' HD3' ' HA ' ' A' ' 122' ' ' LYS . 0.1 OUTLIER -130.65 20.32 5.11 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 120.917 0.389 . . . . 0.0 111.44 173.608 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 89.1 p -65.92 161.93 20.21 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.949 176.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 15.5 p-10 -62.76 -43.66 98.21 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.354 -179.49 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.404 ' O ' ' HG ' ' A' ' 129' ' ' LEU . 7.7 tp -62.61 -39.22 83.81 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.607 178.338 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 126' ' ' TYR . . . . . 0.443 ' O ' ' HG2' ' A' ' 130' ' ' MET . 58.0 t80 -66.8 -40.43 88.08 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 110.131 -0.322 . . . . 0.0 110.131 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 83.3 mt -61.74 -37.18 83.27 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.311 177.151 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -62.66 -43.17 99.5 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.188 175.153 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' A' ' 125' ' ' ILE . 95.1 mt -63.73 -30.0 71.15 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.606 176.931 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 130' ' ' MET . . . . . 0.443 ' HG2' ' O ' ' A' ' 126' ' ' TYR . 21.4 mmt -78.6 -27.8 45.62 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.619 177.74 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 44.45 22.84 0.06 Allowed 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.375 1.07 . . . . 0.0 112.989 179.454 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . -90.59 -24.87 27.09 Favored Glycine 0 C--N 1.331 0.251 0 N-CA-C 111.744 -0.542 . . . . 0.0 111.744 177.794 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 35.4 mmt180 -134.78 124.14 16.56 Favored Pre-proline 0 C--O 1.233 0.229 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 179.357 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo . . . . . 0 C--N 1.347 0.493 0 C-N-CA 122.551 2.167 . . . . 0.0 111.68 177.66 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 47.0 m . . . . . 0 N--CA 1.48 1.06 0 CA-C-O 120.584 0.23 . . . . 0.0 110.462 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 27.0 ptt? -159.1 169.92 23.16 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 120.745 0.307 . . . . 0.0 110.398 179.335 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.7 p -136.79 141.2 41.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.319 -179.511 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 34.8 t -88.91 148.11 40.51 Favored Pre-proline 0 C--N 1.327 -0.404 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 177.052 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_endo -48.62 -33.24 23.52 Favored 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 122.839 2.359 . . . . 0.0 111.869 179.286 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.567 ' O ' HG22 ' A' ' 9' ' ' VAL . 36.3 mt-10 -63.14 -54.16 42.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.143 178.035 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -63.3 -29.29 70.64 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.081 0.467 . . . . 0.0 109.959 178.03 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.22 -40.04 82.2 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.358 -179.348 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.567 HG22 ' O ' ' A' ' 6' ' ' GLU . 25.5 m -71.51 -21.92 21.75 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.269 0 C-N-CA 120.489 -0.484 . . . . 0.0 110.024 177.347 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.596 ' O ' ' HG2' ' A' ' 13' ' ' GLU . 5.6 mptp? -69.52 -16.37 63.42 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.852 173.186 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 42.8 m0 -80.3 -16.46 54.58 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.767 -0.456 . . . . 0.0 109.767 174.47 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -96.02 13.69 65.66 Favored Glycine 0 C--N 1.334 0.45 0 CA-C-N 115.708 -0.678 . . . . 0.0 112.858 -178.636 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.596 ' HG2' ' O ' ' A' ' 10' ' ' LYS . 11.5 pt-20 -111.78 -28.38 8.11 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 120.881 0.372 . . . . 0.0 110.457 175.708 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.8 m -152.6 117.51 5.12 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.322 -177.032 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 12.3 t80 -56.58 -36.84 69.8 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 172.223 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -52.19 -45.2 65.09 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 115.069 -0.969 . . . . 0.0 110.858 175.794 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.554 ' HD2' ' O ' ' A' ' 10' ' ' LYS . 40.4 ttmt -70.19 -36.29 74.52 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.301 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 67.3 tp -58.82 -43.41 90.64 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.078 176.259 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 51.5 tp -74.02 -34.71 64.22 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.574 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 33.6 t -63.81 -28.94 70.21 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.533 179.168 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.449 ' HB3' ' H ' ' A' ' 24' ' ' GLY . 1.5 m-70 -84.49 115.64 22.68 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 175.783 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.63 ' NH1' ' HB3' ' A' ' 22' ' ' ARG . 4.6 ttp-105 -56.49 -31.63 64.23 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 176.438 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -64.06 -46.71 83.16 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.397 176.38 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.449 ' H ' ' HB3' ' A' ' 21' ' ' HIS . . . -62.93 -44.62 97.14 Favored Glycine 0 N--CA 1.45 -0.393 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.658 179.309 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 13.3 tp -52.36 -57.39 9.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.144 0.497 . . . . 0.0 110.475 174.651 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -58.74 -39.49 81.04 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-N 115.25 -0.886 . . . . 0.0 111.199 -175.434 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -71.4 -45.47 62.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.022 0.439 . . . . 0.0 110.976 179.017 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.478 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 74.2 t80 -72.98 -30.28 63.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.226 -174.876 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 13.6 t -76.02 -39.09 56.44 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 -177.748 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 37.2 ttt180 -59.72 -39.37 84.45 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.905 171.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.512 ' O ' HG22 ' A' ' 34' ' ' THR . 68.0 t80 -62.59 -53.45 54.39 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.822 -178.502 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.599 HD13 ' HA ' ' A' ' 38' ' ' GLU . 2.7 pp -73.91 -16.12 61.11 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 120.761 0.315 . . . . 0.0 111.406 -179.493 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.616 ' HD2' ' HB3' ' A' ' 38' ' ' GLU . 12.7 mptt -65.38 -50.23 66.32 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 120.962 0.41 . . . . 0.0 110.086 175.785 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.512 HG22 ' O ' ' A' ' 31' ' ' PHE . 13.8 t -68.66 -17.96 64.19 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.885 -174.262 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.557 ' HG2' ' HA ' ' A' ' 32' ' ' LEU . 12.5 pt-20 -97.56 8.76 44.05 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.736 0.303 . . . . 0.0 110.631 176.974 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 91.7 m-85 57.96 39.58 26.42 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.727 173.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 26.1 m -124.81 34.59 4.96 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.446 0.641 . . . . 0.0 109.3 177.179 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.616 ' HB3' ' HD2' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -83.43 -30.75 27.06 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.13 -0.941 . . . . 0.0 112.857 -170.079 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.437 ' HB3' ' NZ ' ' A' ' 77' ' ' LYS . 0.4 OUTLIER -57.71 -22.25 45.27 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 120.823 -0.351 . . . . 0.0 110.9 -177.058 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.538 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 58.1 m-80 -66.74 -50.46 62.69 Favored 'General case' 0 C--O 1.239 0.514 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.435 179.06 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.431 HG22 ' O ' ' A' ' 38' ' ' GLU . 13.9 tt -69.38 -40.67 80.31 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 C-N-CA 120.916 -0.314 . . . . 0.0 110.191 -178.751 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -61.69 -30.94 71.07 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.404 175.128 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.538 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 78.4 t80 -59.87 -66.58 0.49 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.405 179.603 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.643 ' HB2' ' HG3' ' A' ' 105' ' ' GLN . 47.2 p-90 -75.55 -18.5 59.75 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 120.176 -0.61 . . . . 0.0 112.516 -171.9 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 13.0 tt -73.39 -32.8 38.42 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 173.738 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.56 -27.69 65.34 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.927 -0.578 . . . . 0.0 109.904 174.346 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.506 ' SG ' ' HB2' ' A' ' 101' ' ' PHE . 41.4 t -68.83 -42.96 76.49 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.181 175.134 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 18.2 tp10 -65.1 -36.95 85.92 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 176.317 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.595 ' HA ' ' HE3' ' A' ' 52' ' ' LYS . 10.4 t70 -64.9 -38.26 90.38 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.378 173.995 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.491 ' HA ' ' HE2' ' A' ' 62' ' ' LYS . 8.5 t80 -56.15 -39.89 73.01 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.626 177.375 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.599 ' HB2' ' NZ ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -97.47 -5.28 36.37 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.826 0.676 . . . . 0.0 112.826 -173.656 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.595 ' HE3' ' HA ' ' A' ' 49' ' ' ASP . 18.4 ptpt -74.38 -28.4 61.09 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 175.267 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.2 p -74.24 150.5 40.26 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.982 174.829 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.64 4.7 5.54 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 111.678 0.251 . . . . 0.0 111.678 -177.955 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLY . . . . . 0.494 ' O ' HG12 ' A' ' 59' ' ' ILE . . . -75.12 120.44 6.2 Favored Glycine 0 CA--C 1.52 0.372 0 N-CA-C 111.169 -0.772 . . . . 0.0 111.169 175.652 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_exo -49.0 -62.3 0.45 Allowed 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 122.878 2.386 . . . . 0.0 112.777 -175.498 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.83 -34.52 74.68 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 120.903 0.382 . . . . 0.0 110.519 -179.224 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -60.65 -41.39 94.91 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.955 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.494 HG12 ' O ' ' A' ' 55' ' ' GLY . 44.2 mm -59.0 -41.44 83.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.683 179.096 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 79.1 m80 -64.95 -50.46 66.3 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.443 -177.237 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.458 HD12 ' N ' ' A' ' 62' ' ' LYS . 4.4 pp -70.54 -31.02 67.92 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.476 -175.309 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.491 ' HE2' ' HA ' ' A' ' 50' ' ' PHE . 60.5 mtpt -71.93 -41.73 67.49 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 120.777 0.323 . . . . 0.0 110.299 176.82 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.475 ' HB2' ' CE1' ' A' ' 50' ' ' PHE . . . -60.85 -44.69 96.67 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.691 178.427 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -65.51 -41.12 93.52 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.629 -177.82 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.99 -50.54 73.7 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-O 121.067 0.46 . . . . 0.0 110.567 177.864 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 70.1 mt -62.57 -38.19 80.85 Favored 'Isoleucine or valine' 0 C--O 1.231 0.127 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.327 178.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.577 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 49.1 t80 -55.74 -59.84 4.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.635 178.073 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -67.55 -24.61 65.55 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.427 -0.806 . . . . 0.0 112.603 -170.543 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -105.49 -25.41 12.34 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -176.051 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.529 ' HB3' ' HD1' ' A' ' 43' ' ' PHE . 96.4 m-85 -125.04 -46.12 1.83 Allowed 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 112.678 0.622 . . . . 0.0 112.678 -171.725 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.577 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 48.4 mm -71.04 -37.93 69.62 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 CA-C-O 120.944 0.402 . . . . 0.0 110.647 -173.473 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.405 ' OE1' ' HA ' ' A' ' 72' ' ' GLN . 5.8 tp60 -72.64 129.41 38.19 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.227 179.397 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 27.2 m -60.17 -44.1 95.31 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.204 0.526 . . . . 0.0 110.103 178.077 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -74.82 79.33 2.1 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.152 175.254 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -132.3 156.82 79.64 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.727 -175.588 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -67.74 -30.32 34.34 Favored 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 122.704 2.269 . . . . 0.0 112.259 -179.178 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.437 ' NZ ' ' HB3' ' A' ' 39' ' ' GLU . 26.0 tptp -105.0 -39.4 6.26 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.981 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.436 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 51.5 mt-10 69.3 154.27 0.11 Allowed 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.297 -177.377 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.433 HG21 ' CD1' ' A' ' 43' ' ' PHE . 88.2 t -140.05 147.86 23.25 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.496 175.603 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 83.6 m-20 -86.79 87.75 7.52 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.122 0.487 . . . . 0.0 109.97 178.735 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.495 HD11 HG21 ' A' ' 85' ' ' THR . 37.3 tp -134.86 145.67 48.51 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.79 -177.853 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -54.73 158.9 2.42 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-N 115.683 -0.69 . . . . 0.0 112.487 -177.814 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 55.7 m-85 -73.69 -57.25 4.11 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.79 -177.874 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.447 ' O ' HG23 ' A' ' 88' ' ' VAL . 86.3 t60 -64.27 -31.03 72.08 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.996 -175.977 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.495 HG21 HD11 ' A' ' 81' ' ' LEU . 76.0 m -59.61 -51.76 68.43 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.67 179.205 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 9.7 ptpp? -71.24 -25.27 62.41 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.263 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -63.53 -41.64 98.47 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 121.231 0.539 . . . . 0.0 110.233 176.047 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 84' ' ' HIS . 81.3 t -64.06 -37.97 81.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 121.25 0.547 . . . . 0.0 109.66 174.943 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 75.6 mt -66.14 -40.3 86.71 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.258 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.424 ' O ' HG22 ' A' ' 93' ' ' ILE . 40.2 p -61.78 -36.13 80.16 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 120.991 0.424 . . . . 0.0 110.376 179.483 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 28.7 m-80 -73.68 -29.23 62.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.903 175.316 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 50.5 m -94.8 -2.7 50.39 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -175.593 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.424 HG22 ' O ' ' A' ' 90' ' ' THR . 9.9 tp -61.35 -27.58 42.18 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.384 0 CA-C-O 120.874 0.369 . . . . 0.0 110.924 -177.269 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 15.0 t -78.97 -18.29 53.98 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.099 -178.633 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 80.6 mm-40 -140.58 75.66 26.01 Favored Pre-proline 0 N--CA 1.465 0.313 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.28 -179.614 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -75.08 143.07 28.36 Favored 'Trans proline' 0 C--O 1.236 0.377 0 C-N-CA 122.398 2.065 . . . . 0.0 111.688 178.391 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.495 HG22 ' H ' ' A' ' 98' ' ' LEU . 3.4 m -130.09 168.43 16.78 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 -178.701 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.495 ' H ' HG22 ' A' ' 97' ' ' THR . 3.2 mm? -64.71 3.73 0.49 Allowed 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 -170.119 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -157.14 19.72 0.3 Allowed 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 118.485 0.584 . . . . 0.0 111.854 174.301 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 30.0 m -55.21 -37.1 66.69 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 121.035 0.445 . . . . 0.0 111.789 -178.071 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.506 ' HB2' ' SG ' ' A' ' 47' ' ' CYS . 10.7 m-85 -89.79 16.89 7.27 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.519 -175.416 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -69.83 -32.96 71.67 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 120.85 0.357 . . . . 0.0 110.51 -177.606 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.9 -43.94 97.82 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 121.188 0.518 . . . . 0.0 109.943 176.148 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.13 -42.72 96.71 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.033 177.146 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.643 ' HG3' ' HB2' ' A' ' 44' ' ' TRP . 57.4 tt0 -57.34 -42.7 82.46 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.406 177.721 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 46.7 t -63.17 -53.22 56.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.996 -179.577 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' ARG . . . . . 0.436 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 20.0 mmm180 -57.21 -44.81 84.04 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.86 -174.342 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 57.7 t -77.26 -37.32 25.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.144 -175.851 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -60.57 -52.35 65.55 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.595 176.808 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.436 ' HG3' ' O ' ' A' ' 107' ' ' ARG . 5.0 pp0? -64.53 -31.31 72.47 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.064 0.459 . . . . 0.0 110.298 -178.745 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.414 ' HB2' ' O ' ' A' ' 107' ' ' ARG . 31.7 tp -65.74 -44.01 87.25 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.831 -176.579 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 28.1 mtm -72.49 -34.53 67.74 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 177.157 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' GLU . . . . . 0.602 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 7.1 tm-20 -57.56 -63.3 1.28 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.552 -178.328 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -54.8 -26.04 32.18 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.115 -0.493 . . . . 0.0 112.128 -174.879 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -103.66 -74.26 0.65 Allowed 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 120.803 0.335 . . . . 0.0 111.795 -176.459 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 15.6 t -64.84 -31.94 73.41 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.923 -170.442 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' TYR . . . . . 0.602 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 38.3 t80 -63.85 -40.88 97.6 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.617 0.246 . . . . 0.0 111.051 -176.743 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 63.5 p -61.72 -45.92 91.87 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-O 121.536 0.684 . . . . 0.0 109.965 179.177 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 52.8 mtp180 -59.58 -41.27 89.87 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.145 176.88 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 77.6 t80 -59.53 -34.2 72.34 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.46 179.576 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 94.5 mt -71.05 -26.01 62.9 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.161 178.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -115.89 21.43 13.82 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.393 177.706 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 97.9 p -75.7 152.21 37.53 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 120.645 0.26 . . . . 0.0 110.785 179.496 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -61.48 -29.14 69.78 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.353 0.597 . . . . 0.0 109.4 176.038 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.427 ' O ' ' HG ' ' A' ' 129' ' ' LEU . 45.2 mm -61.24 -52.93 55.69 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 115.087 -0.96 . . . . 0.0 110.21 174.343 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 126' ' ' TYR . . . . . 0.433 ' O ' ' HG2' ' A' ' 130' ' ' MET . 53.0 t80 -62.73 -38.74 91.68 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.587 -177.963 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 97.7 mt -60.77 -33.69 73.34 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.323 177.538 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -74.65 -34.3 62.7 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.373 177.192 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 125' ' ' ILE . 85.7 mt -71.26 -18.24 62.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.61 178.275 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 130' ' ' MET . . . . . 0.433 ' HG2' ' O ' ' A' ' 126' ' ' TYR . 21.6 mmt -75.67 -85.67 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.913 178.634 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 53.61 33.85 17.36 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.202 -176.941 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . -81.8 49.9 4.16 Favored Glycine 0 C--N 1.333 0.378 0 C-N-CA 121.306 -0.473 . . . . 0.0 112.152 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 20.0 tpt180 -75.26 112.03 16.63 Favored Pre-proline 0 CA--C 1.535 0.369 0 C-N-CA 123.067 0.547 . . . . 0.0 110.72 -178.323 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_endo . . . . . 0 C--N 1.346 0.412 0 C-N-CA 122.679 2.253 . . . . 0.0 111.769 177.244 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 50.5 p . . . . . 0 N--CA 1.476 0.868 0 CA-C-O 120.845 0.355 . . . . 0.0 110.754 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 4.5 ppp? -150.96 149.58 29.78 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 174.261 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.446 HG21 ' CZ2' ' A' ' 11' ' ' TRP . 7.1 p -105.81 137.88 33.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 120.88 0.371 . . . . 0.0 111.502 -175.775 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.7 m -76.83 151.54 82.32 Favored Pre-proline 0 C--O 1.236 0.362 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.334 176.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -53.59 -34.89 75.1 Favored 'Trans proline' 0 C--N 1.351 0.67 0 C-N-CA 122.877 2.385 . . . . 0.0 112.652 -177.192 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 46.3 mm-40 -60.48 -52.87 63.35 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.966 -179.505 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.533 ' HA ' ' HE2' ' A' ' 10' ' ' LYS . 22.1 tp10 -65.27 -37.8 88.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.074 178.565 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.07 -53.56 57.0 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.232 -179.554 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.797 HG12 ' SD ' ' A' ' 130' ' ' MET . 22.9 m -66.94 -25.55 34.68 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-O 121.26 0.553 . . . . 0.0 110.572 -179.589 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.551 ' HG2' ' HE2' ' A' ' 17' ' ' LYS . 35.2 ttpt -76.14 -9.52 58.69 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.396 -175.618 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.446 ' CZ2' HG21 ' A' ' 3' ' ' VAL . 45.9 m0 -66.98 -18.22 65.28 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.419 0.152 . . . . 0.0 111.1 177.773 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -76.26 60.87 3.13 Favored Glycine 0 C--N 1.333 0.374 0 CA-C-N 116.098 -0.501 . . . . 0.0 112.829 -177.617 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -150.74 -39.41 0.13 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.0 0.429 . . . . 0.0 110.34 176.322 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.413 ' HB3' ' OD1' ' A' ' 16' ' ' ASP . 69.3 m -142.1 125.08 16.17 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.678 -176.649 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.403 ' CZ ' ' SD ' ' A' ' 112' ' ' MET . 33.9 t80 -58.95 -40.21 84.01 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.028 178.489 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.413 ' OD1' ' HB3' ' A' ' 14' ' ' SER . 7.9 p-10 -64.66 -29.74 70.75 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.641 -0.708 . . . . 0.0 110.862 179.509 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.551 ' HE2' ' HG2' ' A' ' 10' ' ' LYS . 65.7 tttp -65.87 -38.22 88.21 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 121.163 0.506 . . . . 0.0 109.828 176.84 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.455 HD21 ' HB2' ' A' ' 28' ' ' PHE . 54.5 tp -59.91 -48.05 83.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.248 176.467 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -72.55 -25.56 61.4 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.178 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 30.2 t -60.02 -27.73 67.15 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 121.326 0.584 . . . . 0.0 109.572 176.119 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 71.5 m-70 -100.46 118.9 37.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.52 176.272 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 92.4 mtt180 -64.48 -27.34 68.92 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.87 0.367 . . . . 0.0 110.083 179.596 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -65.21 -41.28 94.63 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.861 172.546 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -67.7 -45.73 73.62 Favored Glycine 0 C--N 1.331 0.274 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.522 178.479 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 7.7 tt -54.74 -42.6 71.8 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.166 -0.517 . . . . 0.0 110.003 175.457 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.487 ' O ' ' HG2' ' A' ' 30' ' ' ARG . 19.2 tp10 -58.03 -53.77 54.46 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.267 178.849 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -61.14 -40.2 92.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.262 -178.122 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.455 ' HB2' HD21 ' A' ' 18' ' ' LEU . 80.9 t80 -68.47 -48.7 63.82 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.201 -176.804 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.8 t -61.61 -34.51 75.78 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-O 120.72 0.295 . . . . 0.0 110.339 -177.44 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.487 ' HG2' ' O ' ' A' ' 26' ' ' GLU . 26.5 mmt180 -59.38 -52.0 67.49 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.335 176.844 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -64.35 -42.23 96.33 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.669 179.054 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.407 HD22 ' CE2' ' A' ' 28' ' ' PHE . 13.7 tp -65.55 -27.62 68.57 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.582 -176.036 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.563 ' HG2' ' HB3' ' A' ' 38' ' ' GLU . 56.9 mttm -75.13 -43.93 49.88 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.082 177.104 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.1 t -71.41 -17.95 62.37 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 120.93 0.395 . . . . 0.0 110.177 177.53 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -92.09 13.47 18.8 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.632 174.552 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 41.7 p90 46.61 22.75 0.19 Allowed 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.353 1.061 . . . . 0.0 112.87 178.258 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 24.4 m -107.98 18.28 21.42 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.102 0.477 . . . . 0.0 110.153 179.049 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.563 ' HB3' ' HG2' ' A' ' 33' ' ' LYS . 11.6 pt-20 -54.23 -19.88 5.99 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.824 -178.324 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -49.84 -48.02 51.27 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.906 176.951 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 10.1 m120 -57.42 -61.28 2.6 Favored 'General case' 0 C--O 1.244 0.799 0 CA-C-O 121.133 0.492 . . . . 0.0 111.878 -173.644 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.566 HG23 ' HG3' ' A' ' 42' ' ' GLU . 7.1 tp -56.3 -46.88 81.78 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.36 -177.467 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.566 ' HG3' HG23 ' A' ' 41' ' ' ILE . 46.9 mt-10 -78.6 -11.82 59.99 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.412 -176.333 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -70.74 -65.89 0.68 Allowed 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 116.561 -0.29 . . . . 0.0 110.32 177.705 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.487 ' HA ' ' SG ' ' A' ' 47' ' ' CYS . 22.8 p-90 -73.3 -19.51 61.02 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 119.6 -0.84 . . . . 0.0 111.484 -177.003 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 11.0 mt -60.56 -42.6 92.14 Favored 'Isoleucine or valine' 0 C--O 1.236 0.384 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 167.784 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.8 -28.73 62.75 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.914 178.873 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.509 ' O ' ' HB3' ' A' ' 50' ' ' PHE . 77.3 m -66.04 -37.06 84.9 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.798 179.233 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -77.93 -26.89 49.2 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.824 177.443 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.781 ' HA ' ' HE3' ' A' ' 52' ' ' LYS . 16.0 t70 -63.78 -39.37 94.08 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.577 0.703 . . . . 0.0 109.235 169.683 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.509 ' HB3' ' O ' ' A' ' 47' ' ' CYS . 91.4 t80 -61.51 -44.56 96.85 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.668 -1.151 . . . . 0.0 109.921 175.043 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.426 ' HA ' ' O ' ' A' ' 98' ' ' LEU . 23.7 ttpp -58.68 -39.22 80.07 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.831 -177.821 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.781 ' HE3' ' HA ' ' A' ' 49' ' ' ASP . 23.2 pttp -83.82 1.59 42.32 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 120.777 0.322 . . . . 0.0 111.647 -176.55 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 14.6 m -103.35 54.35 0.76 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.76 0.79 . . . . 0.0 108.934 175.265 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.93 -4.73 2.34 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.325 -1.307 . . . . 0.0 113.807 -167.511 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -61.24 116.27 9.1 Favored Glycine 0 C--O 1.224 -0.477 0 C-N-CA 120.533 -0.841 . . . . 0.0 111.25 177.554 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -44.72 -47.53 11.45 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 123.419 2.746 . . . . 0.0 113.133 -173.881 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLN . . . . . 0.459 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 50.8 mt-30 -63.37 -50.66 69.06 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 121.021 0.439 . . . . 0.0 109.844 178.686 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -55.97 -37.65 69.35 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.599 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.5 HG23 ' CZ ' ' A' ' 50' ' ' PHE . 23.9 mm -57.74 -53.02 50.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.714 178.035 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 7.3 m80 -63.38 -36.18 82.86 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.748 0.308 . . . . 0.0 110.682 -178.061 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.459 ' HG ' ' O ' ' A' ' 57' ' ' GLN . 88.5 mt -64.92 -50.56 66.0 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.931 -179.72 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -69.89 -36.47 75.45 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.872 -178.236 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.76 -48.24 82.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.674 179.553 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 20.3 tptp -68.38 -29.75 68.52 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.192 -179.266 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -65.81 -61.35 2.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.076 175.816 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 71.2 mt -55.2 -32.99 29.26 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.168 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.581 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.481 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 77.2 t80 -54.77 -66.16 0.45 Allowed 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.535 177.789 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.41 ' HG3' ' HD2' ' A' ' 67' ' ' TYR . 38.0 mt-10 -76.88 -12.34 59.95 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.911 -174.912 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 54.3 tptt -92.82 -32.84 14.49 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.247 -177.908 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.425 ' HB3' ' CG2' ' A' ' 79' ' ' VAL . 80.5 m-85 -133.49 -49.32 0.84 Allowed 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -172.934 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.481 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 49.8 mm -67.53 -28.25 41.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 CA-C-O 121.096 0.475 . . . . 0.0 111.071 -171.486 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.542 ' HB3' ' HB2' ' A' ' 75' ' ' ALA . 0.0 OUTLIER -65.49 125.9 26.62 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.493 178.677 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 25.0 m -58.38 -30.03 66.48 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 121.27 0.557 . . . . 0.0 110.426 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 42.1 m-20 -109.42 94.02 4.82 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 170.675 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.542 ' HB2' ' HB3' ' A' ' 72' ' ' GLN . . . -152.37 164.89 18.84 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 115.439 -0.801 . . . . 0.0 109.832 -176.244 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.403 ' HD2' ' HB1' ' A' ' 75' ' ' ALA . 82.1 Cg_exo -46.77 -45.35 20.44 Favored 'Trans proline' 0 C--N 1.357 0.974 0 C-N-CA 122.643 2.228 . . . . 0.0 112.299 178.556 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -130.51 89.96 2.85 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 173.95 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.412 ' O ' ' HG2' ' A' ' 78' ' ' GLU . 0.6 OUTLIER -68.6 117.19 10.02 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.437 -179.12 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.425 ' CG2' ' HB3' ' A' ' 70' ' ' PHE . 97.3 t -69.31 138.81 21.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.615 178.895 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -79.45 30.72 0.23 Allowed 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.151 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.437 HD11 HG21 ' A' ' 85' ' ' THR . 39.4 tp -75.06 146.03 41.84 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.706 -175.844 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -53.04 145.94 12.12 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.26 -0.882 . . . . 0.0 112.052 178.569 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.417 ' HA ' ' HG2' ' A' ' 86' ' ' LYS . 39.9 p90 -66.71 -38.97 87.79 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.38 -176.336 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 79.8 t60 -69.42 -35.02 75.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.842 0.353 . . . . 0.0 110.361 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.437 HG21 HD11 ' A' ' 81' ' ' LEU . 21.4 m -70.34 -45.77 65.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.739 -179.56 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.487 ' O ' HG23 ' A' ' 90' ' ' THR . 19.3 ptpt -64.64 -31.12 72.2 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 178.961 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -58.73 -47.49 84.43 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.197 176.305 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 65.0 t -58.74 -43.08 87.04 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 CA-C-O 121.036 0.446 . . . . 0.0 110.284 177.724 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 65.0 mt -61.69 -46.9 95.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.17 -179.499 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.487 HG23 ' O ' ' A' ' 86' ' ' LYS . 78.8 p -60.26 -42.77 96.03 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.099 0.476 . . . . 0.0 110.864 -177.443 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -83.75 -7.01 59.57 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.96 -0.564 . . . . 0.0 112.143 -176.48 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 23.7 m -124.03 6.15 8.6 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 11.1 tp -67.25 -21.39 27.89 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 CA-C-O 120.999 0.428 . . . . 0.0 110.464 -178.031 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 9.9 t -58.73 -36.87 75.0 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.169 178.201 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -141.46 83.95 12.92 Favored Pre-proline 0 C--O 1.233 0.197 0 CA-C-O 120.953 0.406 . . . . 0.0 110.23 -179.379 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.464 ' HG2' HG22 ' A' ' 59' ' ' ILE . 86.2 Cg_endo -81.55 156.56 18.87 Favored 'Trans proline' 0 CA--C 1.532 0.411 0 C-N-CA 122.714 2.276 . . . . 0.0 112.298 178.771 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.405 ' H ' ' HB2' ' A' ' 100' ' ' SER . 62.8 p -86.78 -171.82 3.71 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.575 176.594 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.426 ' O ' ' HA ' ' A' ' 51' ' ' LYS . 34.8 tp -51.04 -37.43 45.35 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.189 0.519 . . . . 0.0 110.847 -177.621 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -152.29 76.84 1.18 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.586 0.708 . . . . 0.0 109.537 170.803 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' SER . . . . . 0.405 ' HB2' ' H ' ' A' ' 97' ' ' THR . 13.1 t -58.83 -19.33 40.42 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 115.172 -0.922 . . . . 0.0 111.485 -176.346 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 75.9 m-85 -77.31 6.22 7.19 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.868 -179.567 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -52.16 -50.86 60.95 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 122.966 0.506 . . . . 0.0 111.034 177.631 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.422 ' O ' ' HD3' ' A' ' 107' ' ' ARG . . . -61.05 -42.58 98.75 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.535 179.253 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.19 -43.25 99.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.616 179.033 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 25.4 tt0 -54.53 -44.44 72.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.373 177.786 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' SER . . . . . 0.439 ' O ' ' HG2' ' A' ' 110' ' ' GLN . 32.1 m -56.96 -47.47 80.62 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.512 179.712 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' ARG . . . . . 0.458 ' O ' ' HG ' ' A' ' 111' ' ' LEU . 12.5 mpt_? -62.9 -63.93 1.06 Allowed 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.548 178.602 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.485 ' O ' ' HG3' ' A' ' 112' ' ' MET . 80.2 t -50.82 -42.45 23.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.435 -175.0 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 32.5 t80 -56.99 -59.53 4.92 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.119 179.159 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.439 ' HG2' ' O ' ' A' ' 106' ' ' SER . 13.8 pt20 -71.26 -20.56 62.21 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 120.553 0.216 . . . . 0.0 111.455 -174.854 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' A' ' 107' ' ' ARG . 76.3 mt -69.65 -41.11 76.0 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.805 -0.18 . . . . 0.0 111.006 178.76 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 112' ' ' MET . . . . . 0.485 ' HG3' ' O ' ' A' ' 108' ' ' VAL . 0.0 OUTLIER -91.55 -12.02 35.63 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 120.955 -0.298 . . . . 0.0 110.79 178.932 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 113' ' ' GLU . . . . . 0.512 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 42.5 tt0 -68.05 -56.71 7.88 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 171.951 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -58.28 -22.88 54.35 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.226 -176.157 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -110.91 -69.28 0.88 Allowed 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 120.976 0.417 . . . . 0.0 111.089 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' SER . . . . . 0.48 ' HA ' ' HB3' ' A' ' 119' ' ' ARG . 22.1 m -69.58 -17.92 63.59 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 -168.805 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 117' ' ' TYR . . . . . 0.512 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 22.5 t80 -68.46 -60.44 2.43 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 118.116 0.417 . . . . 0.0 110.431 177.949 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 20.6 p -65.12 -34.47 78.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.314 0.578 . . . . 0.0 110.272 178.402 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' ARG . . . . . 0.48 ' HB3' ' HA ' ' A' ' 116' ' ' SER . 16.3 ttt180 -55.29 -46.8 76.2 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 114.953 -1.021 . . . . 0.0 109.472 173.313 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -65.62 -41.5 92.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.346 177.588 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.453 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 90.5 mt -58.21 -25.57 61.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.633 0.254 . . . . 0.0 111.21 -179.452 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 11.4 mptt -113.65 7.96 17.44 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 179.083 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 78.4 p -69.41 140.77 54.17 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 171.289 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -54.43 -33.49 59.58 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 111.522 0.193 . . . . 0.0 111.522 -179.354 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 9.9 tp -66.31 -40.81 87.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 CA-C-O 120.743 0.306 . . . . 0.0 110.878 -178.611 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 126' ' ' TYR . . . . . 0.535 ' O ' ' HG2' ' A' ' 130' ' ' MET . 84.7 t80 -72.17 -43.24 64.89 Favored 'General case' 0 C--O 1.232 0.176 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 176.349 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 91.4 mt -61.86 -23.79 66.5 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.199 177.351 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -68.58 -43.56 76.26 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.133 173.094 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 80.9 mt -61.65 -29.4 70.04 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.242 176.338 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' MET . . . . . 0.797 ' SD ' HG12 ' A' ' 9' ' ' VAL . 19.4 mmt -79.43 -65.27 1.02 Allowed 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.632 0.73 . . . . 0.0 110.498 -179.529 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -104.57 -34.65 8.12 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 114.773 -1.103 . . . . 0.0 112.177 -168.848 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 96.39 88.03 1.8 Allowed Glycine 0 C--O 1.237 0.326 0 N-CA-C 110.558 -1.017 . . . . 0.0 110.558 -171.608 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' ARG . . . . . 0.41 ' HA ' ' HD3' ' A' ' 134' ' ' PRO . 37.2 ttm180 -146.98 129.06 7.57 Favored Pre-proline 0 C--N 1.328 -0.369 0 C-N-CA 121.977 0.111 . . . . 0.0 111.012 -169.703 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 134' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 133' ' ' ARG . 12.3 Cg_exo . . . . . 0 C--N 1.348 0.527 0 C-N-CA 122.798 2.332 . . . . 0.0 111.684 173.944 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 17.0 m . . . . . 0 N--CA 1.476 0.866 0 N-CA-C 109.708 -0.479 . . . . 0.0 109.708 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 16.5 ptp -77.05 70.77 3.49 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 121.267 0.556 . . . . 0.0 111.491 -176.902 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.402 HG21 ' CH2' ' A' ' 11' ' ' TRP . 3.2 p -62.38 123.17 14.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.937 175.618 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 17.6 m -62.13 136.24 95.28 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.109 179.493 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.467 ' HA ' ' HB3' ' A' ' 8' ' ' ALA . 8.2 Cg_endo -49.72 -26.77 13.81 Favored 'Trans proline' 0 C--N 1.355 0.872 0 C-N-CA 123.186 2.591 . . . . 0.0 112.464 -178.149 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.594 ' O ' HG22 ' A' ' 9' ' ' VAL . 32.8 tt0 -58.53 -58.06 10.2 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.16 176.168 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -59.25 -37.1 76.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.252 0.548 . . . . 0.0 110.187 175.798 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.467 ' HB3' ' HA ' ' A' ' 5' ' ' PRO . . . -62.5 -39.75 94.5 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.663 -177.642 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.594 HG22 ' O ' ' A' ' 6' ' ' GLU . 27.0 m -72.1 -26.58 25.3 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.297 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.261 178.011 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.587 ' HG2' ' O ' ' A' ' 6' ' ' GLU . 14.4 mmmm -63.31 -38.15 90.03 Favored 'General case' 0 N--CA 1.463 0.207 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 174.702 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.402 ' CH2' HG21 ' A' ' 3' ' ' VAL . 54.0 m0 -61.33 -29.65 70.02 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.634 176.168 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -74.42 6.96 20.49 Favored Glycine 0 CA--C 1.521 0.443 0 CA-C-N 115.64 -0.709 . . . . 0.0 113.719 -176.308 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.502 ' HG3' ' O ' ' A' ' 10' ' ' LYS . 0.0 OUTLIER -132.49 12.0 4.5 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 117.475 0.638 . . . . 0.0 111.244 176.391 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.418 ' HB3' ' HG2' ' A' ' 17' ' ' LYS . 44.2 t -171.0 100.59 0.21 Allowed 'General case' 0 C--O 1.237 0.444 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.169 176.863 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.429 ' HD1' HD23 ' A' ' 18' ' ' LEU . 37.0 t80 -55.12 -29.02 56.82 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.36 176.418 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -57.59 -52.06 66.94 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.994 -179.644 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.418 ' HG2' ' HB3' ' A' ' 14' ' ' SER . 17.7 ptpt -74.42 -28.39 61.05 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 120.946 -0.302 . . . . 0.0 110.533 -174.837 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.429 HD23 ' HD1' ' A' ' 15' ' ' PHE . 16.4 tp -57.19 -51.36 69.62 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.018 173.893 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.554 HD12 ' HA ' ' A' ' 25' ' ' LEU . 15.7 tp -82.9 -22.54 33.9 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.821 -175.508 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 23.2 t -76.71 -25.73 53.91 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.278 178.21 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -73.59 120.87 19.79 Favored 'General case' 0 C--O 1.222 -0.347 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 177.911 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.441 ' O ' ' HB3' ' A' ' 25' ' ' LEU . 60.9 mtp180 -43.06 -56.65 3.25 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.226 0.61 . . . . 0.0 112.551 -173.718 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -72.56 -26.52 61.76 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.816 0.341 . . . . 0.0 110.469 -178.381 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -68.17 -34.55 81.18 Favored Glycine 0 C--N 1.333 0.397 0 N-CA-C 111.384 -0.686 . . . . 0.0 111.384 176.325 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.554 ' HA ' HD12 ' A' ' 19' ' ' LEU . 9.3 tp -58.31 -54.72 43.83 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.536 0.684 . . . . 0.0 109.505 174.423 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.482 ' O ' ' HG2' ' A' ' 30' ' ' ARG . 8.8 tp10 -61.59 -34.58 75.86 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 114.715 -1.13 . . . . 0.0 110.459 -179.408 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.543 ' O ' ' HB2' ' A' ' 30' ' ' ARG . . . -68.28 -52.25 35.87 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 121.053 0.454 . . . . 0.0 111.153 179.323 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -64.75 -39.54 93.8 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.656 -177.711 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.539 ' OG1' ' HE2' ' A' ' 33' ' ' LYS . 3.6 t -64.31 -33.25 75.4 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 -179.482 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.543 ' HB2' ' O ' ' A' ' 27' ' ' ALA . 67.1 mmt-85 -52.43 -51.2 60.4 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.295 0.569 . . . . 0.0 109.556 171.927 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.464 ' O ' HG22 ' A' ' 34' ' ' THR . 69.2 t80 -64.56 -46.81 81.19 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 114.991 -1.004 . . . . 0.0 110.864 -178.158 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.567 ' HG ' ' H ' ' A' ' 38' ' ' GLU . 23.1 tp -70.48 -23.23 62.64 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.418 -175.583 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.539 ' HE2' ' OG1' ' A' ' 29' ' ' THR . 68.4 mttm -86.1 -34.15 20.73 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.771 -0.195 . . . . 0.0 110.964 178.53 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.464 HG22 ' O ' ' A' ' 31' ' ' PHE . 14.3 t -72.37 -22.94 61.07 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 121.08 -0.248 . . . . 0.0 110.854 -178.202 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.434 ' CD ' HH12 ' A' ' 119' ' ' ARG . 12.6 pt-20 -88.27 5.04 43.66 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 120.978 0.418 . . . . 0.0 110.028 174.088 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 33.0 t80 68.7 26.93 6.05 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.63 174.073 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 50.1 m -91.96 -78.52 0.4 Allowed 'General case' 0 CA--C 1.532 0.264 0 O-C-N 122.06 -0.4 . . . . 0.0 110.016 176.312 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.567 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 32.8 tt0 67.37 -64.61 0.25 Allowed 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 112.959 0.726 . . . . 0.0 112.959 175.667 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -39.32 -38.95 0.58 Allowed 'General case' 0 C--O 1.22 -0.484 0 C-N-CA 123.899 0.88 . . . . 0.0 113.061 -174.774 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.535 ' HB2' HD21 ' A' ' 32' ' ' LEU . 43.2 m-80 -50.43 -68.89 0.13 Allowed 'General case' 0 C--O 1.242 0.665 0 CA-C-O 121.062 0.458 . . . . 0.0 111.879 -176.668 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.493 HD12 HD11 ' A' ' 19' ' ' LEU . 3.7 tt -61.95 -44.33 98.76 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.857 -176.346 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -62.89 -31.59 72.68 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.081 -179.053 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 66.2 t80 -65.29 -66.71 0.51 Allowed 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.353 -177.209 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.498 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 33.6 p-90 -71.23 -23.97 62.1 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 119.707 -0.797 . . . . 0.0 111.805 -171.957 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 14.7 tt -66.85 -36.26 76.75 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 C-N-CA 120.213 -0.595 . . . . 0.0 109.592 177.1 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.0 -33.09 75.02 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 121.26 0.552 . . . . 0.0 109.887 173.647 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 72.5 m -70.4 -29.16 65.72 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.364 177.131 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.568 ' O ' ' HG3' ' A' ' 52' ' ' LYS . 37.0 mm-40 -72.93 -30.86 64.22 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 116.671 -0.24 . . . . 0.0 110.517 177.162 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.812 ' HA ' ' HE3' ' A' ' 52' ' ' LYS . 30.3 t70 -61.08 -42.18 98.03 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 172.126 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -63.46 -35.81 81.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.048 174.092 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.535 ' HB2' ' HA ' ' A' ' 48' ' ' GLU . 1.1 tppp? -59.28 -29.45 67.6 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.964 178.136 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.812 ' HE3' ' HA ' ' A' ' 49' ' ' ASP . 9.4 mtmp? -87.46 -19.6 27.77 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.104 -179.03 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 18.8 m -73.36 82.09 1.4 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.343 0.592 . . . . 0.0 111.102 -173.653 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.431 ' HD3' ' O ' ' A' ' 54' ' ' LYS . 0.0 OUTLIER -76.02 103.85 6.27 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.84 178.326 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLY . . . . . 0.524 ' O ' HG12 ' A' ' 59' ' ' ILE . . . 173.1 119.84 0.54 Allowed Glycine 0 N--CA 1.45 -0.406 0 N-CA-C 110.93 -0.868 . . . . 0.0 110.93 178.979 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_endo -55.35 -46.77 30.04 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.74 2.293 . . . . 0.0 112.348 -174.475 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLN . . . . . 0.407 ' OE1' ' N ' ' A' ' 57' ' ' GLN . 7.9 pm0 -67.75 -34.46 76.86 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.192 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -63.38 -40.76 98.11 Favored 'General case' 0 N--CA 1.462 0.14 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 179.149 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.525 HG22 ' HG2' ' A' ' 96' ' ' PRO . 47.3 mm -54.51 -42.03 57.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.907 -179.663 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 46.8 m80 -67.57 -56.1 10.78 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.194 -178.161 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.476 HD12 ' N ' ' A' ' 62' ' ' LYS . 3.9 pp -73.2 -34.46 65.98 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 112.534 0.568 . . . . 0.0 112.534 -171.191 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.476 ' N ' HD12 ' A' ' 61' ' ' LEU . 47.1 mtpt -75.95 -40.72 53.41 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 120.869 -0.333 . . . . 0.0 110.675 179.506 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.15 -41.71 97.07 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.879 0.371 . . . . 0.0 110.228 177.393 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 15.9 tppt? -60.39 -41.51 93.97 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.855 177.314 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.26 -49.4 77.22 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.934 179.159 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 68.8 mt -64.95 -35.76 76.16 Favored 'Isoleucine or valine' 0 C--O 1.234 0.273 0 CA-C-O 121.229 0.538 . . . . 0.0 110.35 178.477 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 74.0 t80 -57.88 -63.14 1.35 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.875 -179.078 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -68.96 -29.27 67.46 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.914 -173.578 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 64.9 tttm -94.93 -17.22 22.19 Favored 'General case' 0 C--O 1.237 0.423 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -172.704 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 99.2 m-85 -133.29 -52.16 0.89 Allowed 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 112.311 0.485 . . . . 0.0 112.311 -177.185 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 50.3 mm -67.03 -44.11 88.53 Favored 'Isoleucine or valine' 0 C--O 1.238 0.45 0 CA-C-O 120.886 0.374 . . . . 0.0 111.417 -172.048 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.465 ' HG3' ' H ' ' A' ' 74' ' ' ASP . 6.3 tp-100 -72.12 145.17 48.32 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.889 -174.624 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.422 ' O ' HG22 ' A' ' 73' ' ' THR . 13.2 m -85.78 27.45 0.86 Allowed 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 121.952 0.882 . . . . 0.0 110.36 178.944 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.465 ' H ' ' HG3' ' A' ' 72' ' ' GLN . 13.9 m-20 -128.83 20.96 5.94 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 174.018 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -86.33 159.38 53.49 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 114.988 -1.006 . . . . 0.0 111.837 -171.139 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_endo -85.65 11.63 3.29 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.964 2.443 . . . . 0.0 111.973 177.143 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.661 ' HA ' ' HE2' ' A' ' 77' ' ' LYS . 0.4 OUTLIER -128.57 -44.41 1.37 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.242 178.394 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 64.52 97.63 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.581 178.818 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 58.2 t -101.3 134.18 42.33 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.271 177.163 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 38.5 m-80 -83.48 27.32 0.61 Allowed 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.538 -176.182 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 9.4 tp -57.45 143.28 41.02 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.552 174.839 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -46.69 128.64 10.8 Favored 'General case' 0 C--O 1.237 0.446 0 O-C-N 123.892 0.745 . . . . 0.0 111.7 -175.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -59.22 -45.75 90.28 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.196 -175.046 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.478 ' O ' ' HB3' ' A' ' 87' ' ' GLU . 54.0 t60 -61.15 -29.63 69.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.898 179.662 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 28.2 m -71.34 -49.41 42.74 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.746 179.075 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.528 ' O ' HG23 ' A' ' 90' ' ' THR . 17.8 ptpt -66.95 -23.22 65.93 Favored 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 120.816 -0.353 . . . . 0.0 110.081 179.769 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.478 ' HB3' ' O ' ' A' ' 84' ' ' HIS . 41.1 tt0 -58.29 -53.09 62.19 Favored 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 171.196 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 58.5 t -58.88 -41.22 82.28 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.335 176.556 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 69.3 mt -60.41 -43.94 95.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.233 -179.515 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.528 HG23 ' O ' ' A' ' 86' ' ' LYS . 76.4 p -61.9 -31.68 72.0 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.214 0.53 . . . . 0.0 110.147 178.904 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 3.5 m-20 -79.95 -16.94 54.23 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.209 179.165 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 20.3 m -108.79 -14.24 14.63 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -176.841 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.0 tp -64.49 -21.61 29.51 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -170.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 7.7 t -57.01 -44.99 83.34 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 120.999 0.428 . . . . 0.0 110.368 177.705 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 -149.64 80.77 7.41 Favored Pre-proline 0 C--O 1.238 0.47 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 178.367 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.525 ' HG2' HG22 ' A' ' 59' ' ' ILE . 74.1 Cg_endo -75.42 -161.67 0.13 Allowed 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 123.058 2.505 . . . . 0.0 112.591 -176.368 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 9.4 m -152.49 165.73 34.18 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.671 -176.198 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -47.32 -60.72 2.31 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 122.644 0.378 . . . . 0.0 111.489 -177.839 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' HIS . . . . . 0.464 ' ND1' ' HD2' ' A' ' 51' ' ' LYS . 77.0 m-70 -95.32 24.54 4.98 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.548 -0.297 . . . . 0.0 111.51 -177.085 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 41.4 t -66.24 -40.15 90.05 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.268 0.556 . . . . 0.0 109.724 176.356 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 81.7 m-85 -88.02 6.91 33.75 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.911 179.1 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ASP . . . . . 0.511 ' O ' ' HB3' ' A' ' 105' ' ' GLN . 9.5 t70 -70.54 -33.88 71.64 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 178.255 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.581 ' O ' ' HG2' ' A' ' 107' ' ' ARG . . . -61.99 -42.51 99.23 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.629 173.561 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.05 -41.03 86.9 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.064 176.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.511 ' HB3' ' O ' ' A' ' 102' ' ' ASP . 15.2 tt0 -53.24 -53.94 43.43 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.954 174.232 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 42.7 t -51.72 -44.98 63.41 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.253 -177.828 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' ARG . . . . . 0.581 ' HG2' ' O ' ' A' ' 103' ' ' ALA . 19.9 mmm180 -62.8 -50.72 69.88 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 120.937 0.398 . . . . 0.0 111.076 -175.49 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 90.7 t -71.52 -42.76 72.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.925 -177.776 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 59.8 t80 -58.12 -53.21 60.8 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.525 179.606 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.534 ' O ' ' HG2' ' A' ' 114' ' ' GLN . 0.0 OUTLIER -64.98 -32.05 73.59 Favored 'General case' 0 N--CA 1.461 0.091 0 N-CA-C 110.159 -0.312 . . . . 0.0 110.159 -178.994 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 58.2 tp -62.14 -62.32 1.86 Allowed 'General case' 0 N--CA 1.46 0.053 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.549 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' MET . . . . . 0.471 ' O ' ' HB3' ' A' ' 116' ' ' SER . 25.4 ptt? -67.72 -21.55 65.29 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-O 120.747 0.308 . . . . 0.0 110.43 -178.443 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 113' ' ' GLU . . . . . 0.528 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 42.6 tt0 -64.22 -55.55 20.79 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 174.723 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 114' ' ' GLN . . . . . 0.534 ' HG2' ' O ' ' A' ' 110' ' ' GLN . 12.6 pt20 -77.5 -18.43 57.08 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.774 -177.046 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -114.96 3.9 14.64 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 -175.798 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' SER . . . . . 0.471 ' HB3' ' O ' ' A' ' 112' ' ' MET . 32.2 t -147.03 -43.53 0.18 Allowed 'General case' 0 N--CA 1.466 0.339 0 O-C-N 122.068 -0.395 . . . . 0.0 111.442 177.726 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 117' ' ' TYR . . . . . 0.528 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 32.4 t80 -65.93 -40.3 91.29 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 120.913 0.387 . . . . 0.0 110.579 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 29.9 p -56.73 -55.01 39.67 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-O 121.665 0.745 . . . . 0.0 110.035 174.774 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' ARG . . . . . 0.434 HH12 ' CD ' ' A' ' 35' ' ' GLU . 27.1 mtp180 -58.2 -35.34 71.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 114.881 -1.054 . . . . 0.0 110.863 176.558 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 79.4 t80 -60.71 -45.3 94.77 Favored 'General case' 0 C--O 1.224 -0.282 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 179.618 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 87.4 mt -63.67 -23.58 67.43 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.954 0.407 . . . . 0.0 110.471 177.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -101.43 0.77 37.44 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.17 -0.468 . . . . 0.0 112.255 179.054 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 76.6 p -76.58 147.08 37.89 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 120.627 0.251 . . . . 0.0 110.513 -176.75 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -58.21 -31.17 67.08 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 175.685 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 43.7 mm -56.69 -48.94 79.99 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 CA-C-N 115.144 -0.935 . . . . 0.0 110.631 175.615 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 126' ' ' TYR . . . . . 0.424 ' O ' ' HG2' ' A' ' 130' ' ' MET . 88.4 t80 -66.43 -43.66 85.04 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.572 -179.252 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -62.14 -34.12 75.76 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.408 178.114 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -64.36 -35.24 80.25 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.061 175.023 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 99.6 mt -76.53 -25.69 54.41 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.84 177.328 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 130' ' ' MET . . . . . 0.424 ' HG2' ' O ' ' A' ' 126' ' ' TYR . 12.7 mmt -71.07 -43.97 66.69 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.338 178.254 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 57.77 17.89 4.47 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.295 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . -88.3 6.65 83.3 Favored Glycine 0 CA--C 1.519 0.322 0 CA-C-N 116.186 -0.461 . . . . 0.0 113.262 -175.409 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 68.3 mtt-85 60.26 91.52 0.08 OUTLIER Pre-proline 0 CA--C 1.537 0.45 0 C-N-CA 122.77 0.428 . . . . 0.0 111.031 -179.789 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo . . . . . 0 C--N 1.348 0.534 0 C-N-CA 122.866 2.377 . . . . 0.0 113.01 -176.924 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 50.4 m . . . . . 0 N--CA 1.477 0.92 0 CA-C-O 120.519 0.199 . . . . 0.0 110.552 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 26.5 mmt -110.74 -170.11 1.58 Allowed 'General case' 0 C--O 1.236 0.351 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 177.369 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.516 HG21 ' CZ2' ' A' ' 11' ' ' TRP . 8.9 p -61.38 142.35 16.29 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 CA-C-O 120.926 0.393 . . . . 0.0 111.264 178.064 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.4 m -91.9 148.81 37.79 Favored Pre-proline 0 CA--C 1.534 0.362 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.059 177.067 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -50.38 -36.49 48.19 Favored 'Trans proline' 0 C--N 1.353 0.768 0 C-N-CA 123.078 2.518 . . . . 0.0 113.007 -176.749 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.566 ' O ' HG22 ' A' ' 9' ' ' VAL . 1.0 OUTLIER -65.65 -41.07 92.99 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 121.473 0.654 . . . . 0.0 110.029 179.844 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.521 ' O ' ' HB2' ' A' ' 10' ' ' LYS . 2.6 tm-20 -69.64 -30.27 67.93 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 178.283 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.83 -44.54 80.86 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.067 178.431 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.669 HG12 ' SD ' ' A' ' 130' ' ' MET . 17.5 m -66.3 -26.07 37.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 CA-C-O 120.942 0.401 . . . . 0.0 110.39 179.495 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.53 ' O ' ' HG2' ' A' ' 13' ' ' GLU . 41.5 mmtm -57.89 -34.56 69.93 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.984 175.038 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.516 ' CZ2' HG21 ' A' ' 3' ' ' VAL . 43.1 m0 -60.08 -32.43 70.95 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 120.871 0.367 . . . . 0.0 110.946 -179.142 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -65.19 -3.15 10.88 Favored Glycine 0 CA--C 1.521 0.448 0 CA-C-N 115.667 -0.697 . . . . 0.0 114.477 -171.907 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.53 ' HG2' ' O ' ' A' ' 10' ' ' LYS . 13.4 pt-20 -91.35 -32.52 15.65 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 117.68 0.74 . . . . 0.0 110.897 179.406 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 51.8 m -150.37 123.58 8.89 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.022 -174.92 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.479 ' HZ ' ' SD ' ' A' ' 112' ' ' MET . 17.9 t80 -58.92 -32.48 69.6 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.984 176.55 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -54.46 -43.73 71.94 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.904 175.253 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -67.59 -42.58 82.26 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.343 179.103 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 68.2 tp -54.44 -38.98 66.93 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.17 177.199 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 53.1 tp -75.11 -28.4 60.21 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.027 179.407 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 38.4 m -68.23 -36.18 79.1 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.258 -177.396 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -86.77 121.5 29.36 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 179.748 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.6 ptm180 -58.08 -28.21 64.36 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.118 0.485 . . . . 0.0 110.292 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -61.75 -49.6 75.76 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.36 174.402 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -63.68 -44.67 96.04 Favored Glycine 0 C--N 1.335 0.492 0 CA-C-N 115.018 -0.992 . . . . 0.0 111.778 179.447 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 15.3 tp -48.7 -60.39 2.76 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 123.018 0.527 . . . . 0.0 111.072 177.314 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.478 ' O ' ' HB2' ' A' ' 30' ' ' ARG . 11.1 tp10 -59.01 -50.01 75.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.874 -175.975 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -60.68 -35.13 75.51 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 121.053 0.454 . . . . 0.0 111.106 -179.084 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 91.9 t80 -75.08 -46.3 35.59 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.861 -176.58 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.58 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 11.9 t -70.75 -27.8 64.22 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 -176.164 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.478 ' HB2' ' O ' ' A' ' 26' ' ' GLU . 0.2 OUTLIER -61.83 -54.73 38.14 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.191 -0.913 . . . . 0.0 109.863 177.714 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.49 ' O ' ' HB ' ' A' ' 34' ' ' THR . 86.9 t80 -57.62 -34.06 68.9 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.178 0.513 . . . . 0.0 110.653 -179.087 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 26.7 tp -74.81 -45.99 39.81 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.947 -178.242 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.58 ' HG3' ' O ' ' A' ' 29' ' ' THR . 68.3 mttm -60.95 -25.4 66.79 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.232 0.539 . . . . 0.0 110.002 177.211 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.49 ' HB ' ' O ' ' A' ' 31' ' ' PHE . 96.4 m -60.77 -35.31 76.09 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.263 177.691 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -101.89 9.78 40.34 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 120.986 0.422 . . . . 0.0 110.481 176.709 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 83.6 m-85 66.23 8.26 5.45 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.478 -0.783 . . . . 0.0 112.572 173.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 21.4 t -92.81 43.33 1.12 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.191 0.52 . . . . 0.0 109.751 -178.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -86.4 2.03 49.11 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.746 -174.711 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.35 -31.57 72.83 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -175.935 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.47 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 6.2 p30 -69.25 -57.99 4.63 Favored 'General case' 0 C--O 1.246 0.88 0 N-CA-C 111.969 0.359 . . . . 0.0 111.969 -176.38 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.517 ' HA ' ' HE1' ' A' ' 112' ' ' MET . 13.8 tt -63.0 -46.81 95.36 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-O 120.574 0.226 . . . . 0.0 110.477 -177.184 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -62.99 -24.5 67.94 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.066 177.681 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.47 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 82.9 t80 -62.75 -63.2 1.28 Allowed 'General case' 0 C--O 1.235 0.312 0 C-N-CA 121.399 -0.121 . . . . 0.0 111.022 179.552 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.605 ' HE1' ' HE3' ' A' ' 112' ' ' MET . 20.9 p-90 -70.97 -19.86 62.5 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 119.439 -0.904 . . . . 0.0 111.468 -175.146 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.419 HG13 ' O ' ' A' ' 41' ' ' ILE . 66.3 mt -67.33 -51.05 56.84 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 CA-C-O 121.293 0.568 . . . . 0.0 109.786 170.846 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.39 -28.6 69.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.514 178.693 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.625 ' SG ' ' HB2' ' A' ' 101' ' ' PHE . 41.0 t -68.58 -33.43 74.05 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.583 -179.722 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.731 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 10.5 pt-20 -83.29 -25.69 31.33 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 120.444 -0.503 . . . . 0.0 110.318 176.661 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.465 ' HA ' ' HE3' ' A' ' 52' ' ' LYS . 18.1 t70 -62.57 -33.37 74.82 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 168.81 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -71.62 -56.12 6.45 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 114.632 -1.167 . . . . 0.0 111.121 174.599 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.731 ' HG2' ' HA ' ' A' ' 48' ' ' GLU . 25.4 pttm -85.03 11.49 9.47 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -171.4 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.465 ' HE3' ' HA ' ' A' ' 49' ' ' ASP . 18.5 ptpt -88.67 -24.19 22.82 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 168.832 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.4 ' HB2' ' HG2' ' A' ' 58' ' ' GLN . 17.3 p -90.25 122.03 32.81 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 174.89 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -100.13 6.16 44.89 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.623 -172.259 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLY . . . . . 0.448 ' O ' HG12 ' A' ' 59' ' ' ILE . . . -67.09 123.03 20.59 Favored Glycine 0 CA--C 1.519 0.309 0 C-N-CA 121.015 -0.612 . . . . 0.0 112.013 179.187 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.401 ' HD2' ' HA2' ' A' ' 55' ' ' GLY . 12.2 Cg_endo -54.05 -46.91 30.12 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.671 2.248 . . . . 0.0 112.067 -177.922 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 82.0 mm-40 -64.29 -40.52 96.13 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 121.346 0.593 . . . . 0.0 109.845 178.545 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.462 ' OE1' HD11 ' A' ' 61' ' ' LEU . 6.5 tp-100 -58.66 -43.29 89.82 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 114.829 -1.078 . . . . 0.0 110.557 -179.116 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.448 HG12 ' O ' ' A' ' 55' ' ' GLY . 42.3 mm -57.29 -49.5 79.75 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.212 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.809 -178.055 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 77.4 m80 -64.45 -54.3 34.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.596 -0.275 . . . . 0.0 111.563 -173.933 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.516 HD12 ' N ' ' A' ' 62' ' ' LYS . 4.2 pp -64.48 -31.83 73.21 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.624 0.249 . . . . 0.0 111.648 -175.88 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.516 ' N ' HD12 ' A' ' 61' ' ' LEU . 36.3 mmtm -71.49 -53.16 14.82 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 120.629 0.252 . . . . 0.0 110.544 176.414 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.69 -38.08 74.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.885 -178.626 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 27.6 tptp -65.49 -41.26 93.46 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.232 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -64.84 -50.81 65.21 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.687 178.463 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 70.6 mt -58.58 -36.56 60.26 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.206 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.198 178.42 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.473 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 91.6 t80 -56.01 -63.65 1.11 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.674 178.327 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -64.4 -35.34 80.6 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.752 -0.658 . . . . 0.0 112.04 -174.794 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 80.9 tttt -90.32 -25.84 20.29 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -170.195 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -127.15 -48.36 1.46 Allowed 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -174.272 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.473 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 48.4 mm -70.56 -38.37 73.24 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 CA-C-O 120.947 0.403 . . . . 0.0 111.19 -173.396 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.503 ' HB3' ' HB2' ' A' ' 75' ' ' ALA . 6.2 tp-100 -61.04 141.37 57.44 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.106 -176.402 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 28.8 m -73.59 -35.06 65.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.237 0.541 . . . . 0.0 110.73 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -93.68 27.66 2.6 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.206 0.527 . . . . 0.0 110.501 175.098 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.503 ' HB2' ' HB3' ' A' ' 72' ' ' GLN . . . -70.93 160.64 81.67 Favored Pre-proline 0 C--O 1.235 0.341 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.49 176.489 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.481 ' HD2' ' HB1' ' A' ' 75' ' ' ALA . 12.2 Cg_endo -55.1 -35.03 89.58 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.799 2.332 . . . . 0.0 112.268 -179.097 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.427 ' O ' ' HB3' ' A' ' 78' ' ' GLU . 33.6 mtmm -122.95 -50.27 1.94 Allowed 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.826 176.895 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.427 ' HB3' ' O ' ' A' ' 77' ' ' LYS . 44.0 tt0 68.9 139.81 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.375 0 O-C-N 123.698 0.623 . . . . 0.0 110.803 -175.132 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.415 ' C ' ' H ' ' A' ' 81' ' ' LEU . 60.8 t -95.44 149.15 4.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.427 175.495 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 41.8 m-80 -70.68 17.24 0.07 Allowed 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 -177.642 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.575 HD11 HG21 ' A' ' 85' ' ' THR . 47.4 tp -60.97 144.07 53.96 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 122.746 0.418 . . . . 0.0 110.822 176.647 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -54.92 143.38 26.33 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.744 -177.054 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.448 ' HA ' ' HG2' ' A' ' 86' ' ' LYS . 89.9 t80 -62.23 -44.7 95.96 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.872 -178.673 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.416 ' O ' HG23 ' A' ' 88' ' ' VAL . 82.0 t60 -66.87 -30.31 70.44 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.567 0.222 . . . . 0.0 110.749 -178.915 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.575 HG21 HD11 ' A' ' 81' ' ' LEU . 27.1 m -69.29 -48.18 62.37 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 177.84 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.513 ' O ' HG23 ' A' ' 90' ' ' THR . 19.0 ptpt -65.97 -28.36 68.84 Favored 'General case' 0 N--CA 1.462 0.129 0 N-CA-C 109.754 -0.462 . . . . 0.0 109.754 178.011 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -60.18 -49.31 78.12 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.148 177.704 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.416 HG23 ' O ' ' A' ' 84' ' ' HIS . 58.3 t -56.4 -40.82 69.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 121.253 0.549 . . . . 0.0 109.678 176.209 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 72.3 mt -63.9 -42.62 96.41 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.968 178.753 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.513 HG23 ' O ' ' A' ' 86' ' ' LYS . 67.9 p -62.61 -25.35 68.05 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.891 0.377 . . . . 0.0 110.9 -178.126 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 57.4 m-80 -90.59 -23.74 20.76 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.252 178.615 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 31.1 t -98.22 -9.64 25.31 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.63 -176.716 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 9.4 tp -60.89 -26.14 37.81 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 N-CA-C 112.003 0.371 . . . . 0.0 112.003 -174.687 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 12.3 t -68.57 -24.41 64.6 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 120.83 0.348 . . . . 0.0 110.791 -179.191 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -144.68 76.05 14.34 Favored Pre-proline 0 CA--C 1.532 0.268 0 CA-C-N 116.213 -0.448 . . . . 0.0 109.907 179.466 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -82.3 153.22 16.12 Favored 'Trans proline' 0 C--O 1.237 0.45 0 C-N-CA 122.671 2.247 . . . . 0.0 112.484 -178.118 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 47.8 p -111.3 174.09 6.03 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.228 176.871 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 34.7 tp -57.78 -57.27 13.49 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.371 0.605 . . . . 0.0 111.111 -178.297 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' HIS . . . . . 0.42 ' ND1' ' HB3' ' A' ' 102' ' ' ASP . 1.2 t-80 -95.85 12.65 29.42 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.326 -171.861 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 22.7 p -44.26 -47.42 9.4 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -172.312 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.625 ' HB2' ' SG ' ' A' ' 47' ' ' CYS . 99.0 m-85 -78.85 11.61 2.56 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.244 0.831 . . . . 0.0 113.244 -171.892 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ASP . . . . . 0.455 ' HA ' ' HG2' ' A' ' 105' ' ' GLN . 8.6 p30 -60.47 -38.68 85.03 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 118.189 0.45 . . . . 0.0 111.545 -177.887 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.07 -38.76 83.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.191 0.519 . . . . 0.0 110.372 176.021 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.8 -36.16 79.92 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.801 -179.655 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.49 ' HG2' ' O ' ' A' ' 101' ' ' PHE . 13.0 mm-40 -56.87 -49.17 76.31 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.308 0.575 . . . . 0.0 109.569 179.822 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 45.2 t -59.12 -49.11 79.14 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.04 -0.982 . . . . 0.0 110.923 -179.024 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 28.1 mmm180 -59.46 -47.33 85.9 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.242 -177.491 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.432 HG21 ' CD2' ' A' ' 43' ' ' PHE . 88.6 t -66.61 -41.54 88.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.156 -178.623 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 65.1 t80 -64.86 -43.43 93.0 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.361 -177.695 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 5.3 pp0? -69.58 -37.25 76.87 Favored 'General case' 0 C--O 1.239 0.512 0 N-CA-C 111.535 0.198 . . . . 0.0 111.535 -175.863 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 4.5 pp -73.58 -24.84 60.13 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-O 120.836 0.35 . . . . 0.0 110.2 179.23 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' MET . . . . . 0.605 ' HE3' ' HE1' ' A' ' 44' ' ' TRP . 34.4 ttm -66.38 -50.17 64.39 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.771 -0.65 . . . . 0.0 109.997 175.136 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' GLU . . . . . 0.573 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 38.2 tt0 -54.88 -57.86 9.91 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.081 -178.127 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -60.88 -9.38 4.08 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 112.963 0.727 . . . . 0.0 112.963 -172.028 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' ASP . . . . . 0.456 ' O ' ' HG3' ' A' ' 119' ' ' ARG . 32.9 t70 -126.93 -68.85 0.78 Allowed 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 120.61 0.243 . . . . 0.0 111.087 178.973 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 22.7 t -60.96 -38.38 85.69 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 111.697 0.258 . . . . 0.0 111.697 -175.768 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' TYR . . . . . 0.573 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 42.0 t80 -71.52 -40.78 69.88 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 120.722 0.296 . . . . 0.0 110.706 -177.261 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 34.5 p -65.93 -43.73 87.23 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 109.905 -0.405 . . . . 0.0 109.905 177.851 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' ARG . . . . . 0.456 ' HG3' ' O ' ' A' ' 115' ' ' ASP . 90.2 mtt180 -55.66 -44.1 76.91 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.135 174.213 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -58.95 -41.98 88.76 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.299 179.188 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 83.6 mt -70.88 -14.86 62.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.811 0.338 . . . . 0.0 111.113 179.134 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' LYS . . . . . 0.623 ' HE3' ' HA ' ' A' ' 122' ' ' LYS . 0.0 OUTLIER -113.88 7.48 17.0 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.601 179.326 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 97.0 p -84.42 148.95 26.31 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 120.624 0.25 . . . . 0.0 111.041 -179.412 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -60.15 -29.92 68.97 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 174.702 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 42.0 mm -55.12 -57.09 8.06 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-N 115.261 -0.881 . . . . 0.0 111.167 178.646 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 126' ' ' TYR . . . . . 0.463 ' O ' ' HG2' ' A' ' 130' ' ' MET . 31.7 t80 -66.22 -38.75 88.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.909 0.385 . . . . 0.0 110.324 -178.236 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 92.1 mt -65.27 -28.57 69.43 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.599 178.512 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -71.9 -37.56 70.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.001 178.194 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 81.0 mt -64.6 -31.84 73.23 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.964 176.352 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 130' ' ' MET . . . . . 0.669 ' SD ' HG12 ' A' ' 9' ' ' VAL . 26.2 mmt -70.15 -52.88 20.04 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.769 176.846 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 60.56 23.22 12.94 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.762 -179.06 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . -69.75 -21.38 76.48 Favored Glycine 0 C--N 1.33 0.249 0 C-N-CA 120.972 -0.632 . . . . 0.0 111.991 179.415 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 8.2 ttp180 -171.67 106.21 0.37 Allowed Pre-proline 0 C--N 1.33 -0.282 0 C-N-CA 122.754 0.421 . . . . 0.0 109.91 179.534 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo . . . . . 0 C--N 1.349 0.598 0 C-N-CA 122.838 2.359 . . . . 0.0 112.039 179.136 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.498 ' HB3' ' HB3' ' A' ' 23' ' ' ASP . 44.0 m . . . . . 0 N--CA 1.476 0.843 0 CA-C-O 121.225 0.536 . . . . 0.0 110.456 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 49.5 ttm -136.74 123.36 21.02 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.711 178.014 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.475 HG12 HD22 ' A' ' 129' ' ' LEU . 14.7 p -77.79 152.86 5.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.901 -174.045 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 29.5 m -95.58 149.24 35.82 Favored Pre-proline 0 CA--C 1.535 0.372 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.434 173.155 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -44.21 -46.39 11.47 Favored 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 123.623 2.882 . . . . 0.0 113.793 -173.056 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.641 ' O ' HG22 ' A' ' 9' ' ' VAL . 33.9 tt0 -61.78 -47.7 83.96 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 120.696 0.284 . . . . 0.0 111.178 -175.8 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -64.35 -34.96 79.35 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.109 0.48 . . . . 0.0 109.889 178.235 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.61 -38.29 89.64 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.235 -179.605 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.641 HG22 ' O ' ' A' ' 6' ' ' GLU . 11.4 m -75.15 -25.89 18.55 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 C-N-CA 120.92 -0.312 . . . . 0.0 110.63 179.833 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.554 ' HG2' ' O ' ' A' ' 6' ' ' GLU . 74.8 mmtt -60.35 -34.48 73.9 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.008 0.432 . . . . 0.0 110.268 176.86 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.416 ' CE3' HD13 ' A' ' 18' ' ' LEU . 49.1 m0 -61.72 -22.37 65.31 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.802 179.451 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -64.61 -13.03 54.73 Favored Glycine 0 CA--C 1.519 0.31 0 CA-C-N 115.848 -0.614 . . . . 0.0 113.072 -178.098 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.527 ' HG2' ' O ' ' A' ' 10' ' ' LYS . 10.7 pt-20 -79.89 -23.19 42.01 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 117.029 0.415 . . . . 0.0 110.739 179.78 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 31.6 t -171.0 132.01 0.83 Allowed 'General case' 0 C--O 1.238 0.469 0 CA-C-O 121.377 0.608 . . . . 0.0 111.716 -177.261 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 28.6 t80 -60.86 -29.04 69.29 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.861 174.385 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -55.85 -43.79 77.39 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.508 175.555 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 33.3 ttmt -66.96 -40.49 87.5 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.479 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.416 HD13 ' CE3' ' A' ' 11' ' ' TRP . 39.1 tp -59.23 -40.5 86.1 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.149 0.499 . . . . 0.0 110.311 175.514 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 39.6 tp -73.86 -36.67 64.86 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.341 -176.429 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 24.6 p -79.56 -23.26 42.92 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.583 -177.017 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.71 114.45 13.15 Favored 'General case' 0 C--O 1.223 -0.304 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 177.193 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.514 ' HD2' ' H ' ' A' ' 22' ' ' ARG . 4.2 mpt_? -56.18 -42.32 76.89 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 120.902 0.382 . . . . 0.0 111.167 -170.709 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.498 ' HB3' ' HB3' ' A' ' 1' ' ' SER . 4.1 p-10 -70.18 -33.05 71.27 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.693 176.365 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -64.72 -54.19 30.13 Favored Glycine 0 C--N 1.332 0.357 0 N-CA-C 111.397 -0.681 . . . . 0.0 111.397 177.716 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.9 tt -54.63 -40.0 68.53 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 123.085 0.554 . . . . 0.0 110.308 174.736 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -60.87 -42.83 98.68 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-O 121.059 0.456 . . . . 0.0 110.305 177.73 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -68.87 -36.88 78.62 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.202 0.525 . . . . 0.0 110.516 178.158 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 77.3 t80 -70.32 -43.22 70.75 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.712 -175.46 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.584 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 7.2 t -64.85 -44.04 91.05 Favored 'General case' 0 C--N 1.333 -0.137 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 178.658 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 87.7 mtm180 -57.85 -27.76 63.51 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-O 121.047 0.451 . . . . 0.0 110.651 178.816 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.522 ' O ' HG22 ' A' ' 34' ' ' THR . 75.9 t80 -83.32 -41.17 18.55 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.779 175.036 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 17.5 tp -76.62 -21.26 55.77 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.744 -171.483 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.584 ' HG3' ' O ' ' A' ' 29' ' ' THR . 68.5 mttm -61.68 -30.51 70.78 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.343 -178.855 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.522 HG22 ' O ' ' A' ' 31' ' ' PHE . 9.6 t -65.37 -31.0 71.89 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.077 -175.601 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -102.3 8.05 40.46 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 120.916 0.388 . . . . 0.0 110.79 179.41 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 88.9 m-85 59.79 20.05 8.87 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.897 174.435 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 33.0 t -85.59 1.06 50.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.197 0.522 . . . . 0.0 110.348 -177.429 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 52.1 tt0 -58.91 -30.85 68.12 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.283 -179.595 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -60.74 -24.16 65.49 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.136 179.772 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.522 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 93.6 m-20 -68.21 -39.96 82.25 Favored 'General case' 0 C--O 1.238 0.459 0 CA-C-O 121.405 0.621 . . . . 0.0 109.424 174.689 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.4 ' O ' HG13 ' A' ' 45' ' ' ILE . 46.0 mt -63.47 -49.73 81.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.422 173.88 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.444 ' HA ' ' HB ' ' A' ' 45' ' ' ILE . 49.9 mt-10 -60.85 -27.21 67.93 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.891 178.273 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.522 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 62.5 t80 -58.67 -62.61 1.73 Allowed 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.302 176.694 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.526 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 16.0 p-90 -74.91 -14.61 60.67 Favored 'General case' 0 CA--C 1.528 0.1 0 C-N-CA 119.66 -0.816 . . . . 0.0 111.442 -177.933 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.444 ' HB ' ' HA ' ' A' ' 42' ' ' GLU . 15.6 mt -61.9 -47.11 94.74 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 167.797 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.83 -30.15 70.27 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.275 177.074 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.419 ' HB3' ' HA ' ' A' ' 44' ' ' TRP . 25.6 t -62.71 -46.28 88.84 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.455 175.897 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.526 ' HG2' ' O ' ' A' ' 44' ' ' TRP . 26.7 mm-40 -64.35 -35.09 79.75 Favored 'General case' 0 C--N 1.333 -0.134 0 N-CA-C 110.133 -0.321 . . . . 0.0 110.133 178.534 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.421 ' HA ' ' HE2' ' A' ' 52' ' ' LYS . 1.3 m-20 -57.61 -47.54 81.88 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 173.234 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.418 ' CZ ' HG23 ' A' ' 59' ' ' ILE . 57.8 t80 -59.73 -39.05 83.43 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.457 177.04 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.441 ' HE3' ' ND1' ' A' ' 99' ' ' HIS . 53.3 mtpt -72.82 -26.61 61.56 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.807 -177.819 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.459 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 65.1 pttt -105.04 -1.89 25.09 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 111.614 0.227 . . . . 0.0 111.614 -178.329 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 35.6 p -79.37 135.48 36.72 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 110.308 -0.256 . . . . 0.0 110.308 177.531 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.68 154.75 20.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.975 0.417 . . . . 0.0 110.499 -179.828 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 99.58 110.83 3.17 Favored Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 111.115 -0.794 . . . . 0.0 111.115 -176.31 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -51.55 -38.88 65.58 Favored 'Trans proline' 0 C--N 1.352 0.736 0 C-N-CA 122.9 2.4 . . . . 0.0 111.851 -177.293 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 -54.54 -49.89 69.23 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.119 178.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 8.5 tp-100 -58.16 -43.49 87.43 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.15 -0.932 . . . . 0.0 110.016 -179.502 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.418 HG23 ' CZ ' ' A' ' 50' ' ' PHE . 46.7 mm -60.88 -46.82 95.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.505 -178.79 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.447 ' O ' ' HG2' ' A' ' 64' ' ' LYS . 1.5 m80 -62.7 -48.14 80.57 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.358 -174.972 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.587 HD12 ' N ' ' A' ' 62' ' ' LYS . 3.6 pp -72.48 -38.05 68.28 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.47 -176.644 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.587 ' N ' HD12 ' A' ' 61' ' ' LEU . 28.7 mmtp -64.76 -38.68 91.79 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.786 0.327 . . . . 0.0 110.566 177.943 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.04 -47.61 77.55 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.499 177.014 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.447 ' HG2' ' O ' ' A' ' 60' ' ' HIS . 48.3 mmtm -62.62 -40.79 98.06 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.898 -179.429 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.83 -55.61 28.06 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.355 -178.404 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 68.0 mt -60.99 -35.99 69.09 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 CA-C-O 121.296 0.57 . . . . 0.0 110.244 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.528 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 79.7 t80 -59.2 -67.99 0.32 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.152 -179.432 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -61.51 -31.52 71.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.254 -0.43 . . . . 0.0 112.013 -173.558 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.42 ' HE3' ' CE2' ' A' ' 70' ' ' PHE . 36.4 ttpt -83.03 -32.26 26.98 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.225 0.454 . . . . 0.0 112.225 -172.699 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.42 ' CE2' ' HE3' ' A' ' 69' ' ' LYS . 51.2 m-85 -131.98 -46.87 0.94 Allowed 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 112.894 0.702 . . . . 0.0 112.894 -174.922 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.528 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 47.7 mm -68.95 -37.14 76.9 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 CA-C-O 120.749 0.309 . . . . 0.0 111.581 -173.215 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.761 ' HG3' ' H ' ' A' ' 74' ' ' ASP . 6.4 tp-100 -57.98 138.29 56.03 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.868 -176.513 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 15.3 m -79.92 9.3 5.5 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.747 0.784 . . . . 0.0 110.708 -179.202 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.761 ' H ' ' HG3' ' A' ' 72' ' ' GLN . 22.0 m-20 -132.9 25.23 4.3 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.245 -0.888 . . . . 0.0 108.744 172.204 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.78 156.02 92.57 Favored Pre-proline 0 CA--C 1.531 0.225 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.031 -178.2 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -62.17 -23.93 75.87 Favored 'Trans proline' 0 C--N 1.35 0.619 0 C-N-CA 122.702 2.268 . . . . 0.0 112.762 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 30.9 mmtp -115.57 -56.84 2.3 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.312 179.167 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 65.8 114.77 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.372 0 O-C-N 123.671 0.607 . . . . 0.0 110.983 -173.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.441 ' O ' HG12 ' A' ' 79' ' ' VAL . 10.6 t -91.88 25.6 0.39 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 CA-C-O 121.118 0.485 . . . . 0.0 110.101 179.187 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 9.5 p30 43.01 27.97 0.12 Allowed 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.821 0.848 . . . . 0.0 112.388 179.277 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.481 HD11 HG21 ' A' ' 85' ' ' THR . 24.5 tp -56.79 145.45 29.3 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.635 -0.712 . . . . 0.0 111.94 -178.47 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -48.03 138.9 8.63 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.135 -0.939 . . . . 0.0 111.808 179.467 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.545 ' HA ' ' HD2' ' A' ' 86' ' ' LYS . 64.5 t80 -64.22 -41.52 96.98 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.826 -174.714 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 85.1 t60 -70.19 -29.5 66.38 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.863 0.363 . . . . 0.0 110.46 -178.701 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.481 HG21 HD11 ' A' ' 81' ' ' LEU . 25.9 m -69.17 -41.12 77.64 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 175.06 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.545 ' HD2' ' HA ' ' A' ' 83' ' ' PHE . 47.4 mttm -54.77 -46.77 74.45 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.504 171.888 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -52.19 -55.38 21.47 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 114.938 -1.028 . . . . 0.0 110.966 -179.001 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 61.9 t -55.06 -43.19 68.69 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 CA-C-O 121.176 0.513 . . . . 0.0 110.601 -179.317 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 74.3 mt -66.63 -41.63 88.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.949 -178.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 68.7 p -66.86 -18.89 65.6 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.0 0.428 . . . . 0.0 110.955 -179.241 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 79.8 m-20 -86.97 -31.6 20.53 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.046 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 22.3 p -107.17 -4.61 18.63 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -175.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 8.0 tp -54.3 -28.11 17.89 Favored 'Isoleucine or valine' 0 C--O 1.238 0.493 0 N-CA-C 112.003 0.372 . . . . 0.0 112.003 -174.707 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.497 HG23 ' HG2' ' A' ' 95' ' ' GLN . 3.4 t -55.1 -48.84 73.03 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.752 177.951 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.497 ' HG2' HG23 ' A' ' 94' ' ' THR . 21.8 pt20 -162.19 82.02 1.76 Allowed Pre-proline 0 CA--C 1.532 0.261 0 CA-C-O 121.282 0.563 . . . . 0.0 109.871 -177.84 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -85.26 167.23 10.68 Favored 'Trans proline' 0 CA--C 1.531 0.374 0 C-N-CA 123.012 2.475 . . . . 0.0 113.227 -174.332 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.441 HG22 ' H ' ' A' ' 98' ' ' LEU . 2.9 m -86.34 169.43 12.95 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.109 179.535 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.441 ' H ' HG22 ' A' ' 97' ' ' THR . 3.6 mm? -50.49 -49.41 55.51 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 122.883 0.473 . . . . 0.0 111.852 -176.915 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' HIS . . . . . 0.441 ' ND1' ' HE3' ' A' ' 51' ' ' LYS . 19.1 m-70 -100.82 33.02 2.93 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 120.86 0.362 . . . . 0.0 111.322 -175.813 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 25.2 p -64.74 -50.27 67.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.946 0.403 . . . . 0.0 110.946 179.053 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -78.59 6.15 9.37 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.528 -179.531 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -58.61 -36.67 74.41 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.163 0.506 . . . . 0.0 110.231 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.9 -44.35 91.21 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.454 174.822 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.58 -39.3 90.68 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.464 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.515 ' HG2' ' HB2' ' A' ' 44' ' ' TRP . 0.7 OUTLIER -57.48 -52.1 66.76 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 115.958 -0.564 . . . . 0.0 109.751 176.185 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 25.2 t -61.44 -38.3 86.7 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.847 -178.613 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' ARG . . . . . 0.571 ' O ' ' HG ' ' A' ' 111' ' ' LEU . 36.7 mmt180 -65.51 -57.1 9.06 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.441 -179.334 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.456 ' HA ' HD12 ' A' ' 111' ' ' LEU . 93.3 t -59.95 -40.58 83.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.892 0.377 . . . . 0.0 110.858 -177.856 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' TYR . . . . . 0.51 ' HA ' ' HE1' ' A' ' 112' ' ' MET . 3.6 t80 -56.0 -49.61 73.16 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.198 177.591 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.526 ' HG2' ' O ' ' A' ' 107' ' ' ARG . 10.5 pt20 -72.51 -17.73 61.72 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.653 -0.249 . . . . 0.0 111.015 -176.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.571 ' HG ' ' O ' ' A' ' 107' ' ' ARG . 73.3 mt -68.39 -58.65 4.04 Favored 'General case' 0 C--O 1.235 0.312 0 O-C-N 123.189 0.305 . . . . 0.0 110.853 178.609 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 112' ' ' MET . . . . . 0.51 ' HE1' ' HA ' ' A' ' 109' ' ' TYR . 0.1 OUTLIER -75.92 -14.41 60.26 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 120.132 -0.627 . . . . 0.0 110.342 -179.002 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 113' ' ' GLU . . . . . 0.598 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 39.3 tt0 -60.91 -61.35 2.64 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.145 0.498 . . . . 0.0 109.761 172.979 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -69.51 5.15 1.47 Allowed 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.816 -0.629 . . . . 0.0 112.595 -173.402 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -129.4 -66.27 0.82 Allowed 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 120.897 0.379 . . . . 0.0 111.302 176.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 7.4 m -72.64 -28.12 62.55 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.951 -172.276 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' TYR . . . . . 0.598 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 34.1 t80 -64.89 -46.97 79.51 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 121.219 -0.192 . . . . 0.0 110.691 -179.081 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 31.7 p -64.13 -43.34 95.58 Favored 'General case' 0 C--O 1.239 0.531 0 CA-C-O 121.131 0.491 . . . . 0.0 110.294 179.327 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 51.8 mtt180 -57.33 -42.85 82.71 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.124 175.283 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.423 ' O ' ' HB2' ' A' ' 126' ' ' TYR . 78.4 t80 -61.53 -42.7 99.21 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.385 179.369 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 90.1 mt -60.04 -32.76 71.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.587 -0.279 . . . . 0.0 111.612 -178.359 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 122' ' ' LYS . . . . . 0.726 ' HE2' ' HA ' ' A' ' 122' ' ' LYS . 10.0 mmpt? -110.73 11.49 22.62 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 111.998 0.37 . . . . 0.0 111.998 -179.331 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 79.4 p -74.48 156.55 36.8 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-O 120.797 0.332 . . . . 0.0 110.718 177.745 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -55.63 -30.29 60.71 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.152 175.319 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.478 ' N ' HD12 ' A' ' 125' ' ' ILE . 2.3 mp -63.09 -49.77 82.06 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.218 -178.978 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 126' ' ' TYR . . . . . 0.423 ' HB2' ' O ' ' A' ' 120' ' ' PHE . 71.0 t80 -65.63 -35.41 80.72 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.777 -177.862 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 88.7 mt -66.36 -34.84 78.88 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.914 0.388 . . . . 0.0 109.956 176.543 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -68.86 -33.26 73.51 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.844 -0.616 . . . . 0.0 109.79 175.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.475 HD22 HG12 ' A' ' 3' ' ' VAL . 88.6 mt -74.04 -32.66 63.43 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.386 176.104 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 130' ' ' MET . . . . . 0.431 ' HA ' ' CE ' ' A' ' 130' ' ' MET . 7.5 mmt -57.0 -55.76 30.47 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.687 176.5 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 69.36 -65.23 0.31 Allowed 'General case' 0 N--CA 1.465 0.325 0 O-C-N 124.08 0.862 . . . . 0.0 111.434 176.679 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . -72.5 -44.79 39.85 Favored Glycine 0 N--CA 1.45 -0.403 0 CA-C-N 115.996 -0.547 . . . . 0.0 113.127 -172.865 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' ARG . . . . . 0.494 ' O ' ' HG3' ' A' ' 133' ' ' ARG . 34.0 ptt180 -113.77 98.31 47.03 Favored Pre-proline 0 CA--C 1.538 0.486 0 CA-C-O 121.201 0.524 . . . . 0.0 111.389 -177.182 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo . . . . . 0 N--CA 1.459 -0.523 0 C-N-CA 122.753 2.302 . . . . 0.0 110.936 171.703 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 37.4 t . . . . . 0 N--CA 1.48 1.037 0 N-CA-C 110.225 -0.287 . . . . 0.0 110.225 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 53.3 ttm 57.18 84.95 0.09 Allowed 'General case' 0 C--O 1.236 0.354 0 O-C-N 123.664 0.603 . . . . 0.0 111.132 178.856 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 2.6 p -66.96 132.07 32.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.459 176.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.6 m -61.74 141.66 94.99 Favored Pre-proline 0 CA--C 1.534 0.339 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.248 178.585 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -55.22 -35.39 90.99 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 122.564 2.176 . . . . 0.0 111.845 -179.65 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -65.48 -49.36 69.37 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 178.009 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -55.65 -44.32 77.09 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.112 176.524 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.34 -57.03 14.81 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.255 -178.734 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 26.5 m -64.03 -26.06 39.6 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 CA-C-O 120.826 0.346 . . . . 0.0 110.682 -179.506 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 16.3 tppt? -68.86 -30.16 68.62 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.499 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.453 ' HZ2' ' ND1' ' A' ' 21' ' ' HIS . 54.5 m0 -62.1 -31.52 71.98 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 121.058 0.456 . . . . 0.0 109.926 174.529 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -59.79 -16.44 38.54 Favored Glycine 0 C--N 1.335 0.508 0 CA-C-N 115.787 -0.642 . . . . 0.0 113.518 -175.056 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -116.77 3.86 12.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.624 0.249 . . . . 0.0 110.987 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 43.9 m -152.02 98.01 2.39 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 120.871 0.367 . . . . 0.0 111.136 -178.3 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 57.1 t80 -65.2 -36.0 82.82 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 121.313 0.578 . . . . 0.0 109.554 178.157 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -58.93 -32.84 69.93 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.278 -0.873 . . . . 0.0 110.325 177.347 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 22.9 ttmm -72.98 -39.17 66.31 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.0 -0.545 . . . . 0.0 109.86 -179.61 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.497 HD22 ' CE1' ' A' ' 117' ' ' TYR . 14.9 tp -56.18 -50.48 71.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.983 174.499 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 34.4 tp -70.55 -31.57 68.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.133 -0.939 . . . . 0.0 111.524 -175.22 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 38.6 p -81.4 -25.77 35.97 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 120.693 0.282 . . . . 0.0 111.113 -179.697 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.453 ' ND1' ' HZ2' ' A' ' 11' ' ' TRP . 23.8 t-80 -85.29 118.0 24.57 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 179.492 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 39.5 mtm180 -42.24 -54.88 3.52 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.08 0.552 . . . . 0.0 111.751 -177.193 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -57.14 -36.36 70.61 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.265 -179.838 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -71.98 -51.31 14.97 Favored Glycine 0 N--CA 1.451 -0.302 0 N-CA-C 111.674 -0.57 . . . . 0.0 111.674 -178.468 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 7.0 tt -54.03 -48.16 70.79 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.247 -0.476 . . . . 0.0 110.277 176.846 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -61.31 -51.23 69.73 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.632 -179.315 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -60.58 -41.62 95.01 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.326 -177.712 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 77.6 t80 -74.9 -42.17 58.33 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.178 -175.616 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.443 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 10.6 t -64.66 -43.5 93.42 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 120.966 -0.293 . . . . 0.0 110.418 -176.771 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.46 -33.04 74.32 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 121.073 0.463 . . . . 0.0 110.006 179.315 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.468 ' O ' HG22 ' A' ' 34' ' ' THR . 92.4 t80 -65.95 -48.99 69.51 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.499 178.686 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 19.5 tp -68.77 -26.16 65.08 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.102 0.477 . . . . 0.0 110.882 -175.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.543 ' HG2' ' HB3' ' A' ' 38' ' ' GLU . 68.4 mttm -85.26 -1.17 56.65 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.611 -179.419 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.468 HG22 ' O ' ' A' ' 31' ' ' PHE . 3.8 t -69.79 -33.34 72.25 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 120.937 0.398 . . . . 0.0 110.339 179.755 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -118.79 16.73 13.54 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.356 178.751 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 83.5 m-85 60.15 28.89 18.5 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 115.418 -0.81 . . . . 0.0 112.009 176.708 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 21.8 t -82.27 4.71 22.57 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 121.884 0.849 . . . . 0.0 108.779 174.642 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.543 ' HB3' ' HG2' ' A' ' 33' ' ' LYS . 13.7 pt-20 -56.42 -19.31 14.38 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 114.577 -1.192 . . . . 0.0 111.629 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.44 ' O ' ' HB2' ' A' ' 43' ' ' PHE . 10.1 mm-40 -45.77 -33.07 2.84 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.083 179.384 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.517 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 49.7 m-80 -72.63 -47.49 47.23 Favored 'General case' 0 C--O 1.24 0.581 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.552 -178.434 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.513 ' HA ' ' HE1' ' A' ' 112' ' ' MET . 13.6 tt -70.94 -45.41 73.15 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 -177.257 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.474 ' OE1' ' HB2' ' A' ' 38' ' ' GLU . 4.2 mp0 -63.26 -23.27 67.35 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.65 174.318 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.517 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 66.8 t80 -62.09 -60.85 3.0 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 120.471 0.176 . . . . 0.0 110.776 177.632 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.656 ' HB2' ' HG3' ' A' ' 105' ' ' GLN . 13.1 p-90 -72.92 -9.68 58.97 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 119.258 -0.977 . . . . 0.0 111.513 -177.58 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.409 HG13 ' O ' ' A' ' 41' ' ' ILE . 79.8 mt -79.82 -33.22 14.64 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 166.968 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.47 ' HA ' ' OD2' ' A' ' 49' ' ' ASP . . . -67.14 -21.62 65.81 Favored 'General case' 0 CA--C 1.522 -0.105 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.64 179.071 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 44.4 t -68.72 -32.82 72.89 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.731 172.824 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.529 ' O ' ' HG2' ' A' ' 51' ' ' LYS . 17.0 mm-40 -75.17 -49.25 20.06 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.316 179.646 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.51 ' HA ' ' HD3' ' A' ' 52' ' ' LYS . 3.1 p30 -70.32 -11.99 61.28 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.465 177.426 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 24.5 t80 -71.76 -49.2 41.09 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.371 174.201 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.529 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 13.1 ptmm? -62.38 -26.08 68.27 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.891 0.376 . . . . 0.0 109.998 176.855 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.51 ' HD3' ' HA ' ' A' ' 49' ' ' ASP . 51.1 mtpt -67.34 -31.44 71.7 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.674 175.22 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 31.6 m -82.32 51.26 1.77 Allowed 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 121.243 0.544 . . . . 0.0 109.81 178.583 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.77 16.83 0.08 Allowed 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 114.052 1.131 . . . . 0.0 114.052 -170.186 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLY . . . . . 0.491 ' O ' HG12 ' A' ' 59' ' ' ILE . . . -65.88 130.64 33.5 Favored Glycine 0 CA--C 1.523 0.569 0 C-N-CA 120.555 -0.831 . . . . 0.0 111.211 175.504 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -50.46 -43.93 42.09 Favored 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 123.058 2.505 . . . . 0.0 113.009 -173.664 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 22.0 tm0? -93.83 -33.15 13.66 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 179.393 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 25.5 tp60 -54.11 -35.6 62.33 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.958 179.391 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.491 HG12 ' O ' ' A' ' 55' ' ' GLY . 27.1 mm -52.77 -42.25 41.5 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.611 176.201 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 22.8 m-70 -65.63 -45.18 84.04 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.52 -177.466 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 91.0 mt -68.03 -43.65 78.28 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.011 -178.504 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.48 ' NZ ' HD11 ' A' ' 66' ' ' ILE . 8.0 tmtt? -66.35 -40.96 90.13 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.512 -177.105 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.9 -41.3 87.39 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.543 176.878 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 14.6 tppt? -53.69 -46.99 70.88 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.723 177.376 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.7 -59.68 4.66 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.579 179.235 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.48 HD11 ' NZ ' ' A' ' 62' ' ' LYS . 66.5 mt -56.73 -35.59 46.28 Favored 'Isoleucine or valine' 0 C--O 1.235 0.336 0 CA-C-O 121.37 0.605 . . . . 0.0 110.522 179.545 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.431 ' OH ' HG22 ' A' ' 90' ' ' THR . 83.1 t80 -62.8 -67.68 0.4 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.171 -176.803 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.505 ' HA ' ' HB2' ' A' ' 72' ' ' GLN . 29.1 mt-10 -77.43 -1.81 32.1 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 -172.909 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 65.8 tttp -100.57 -28.73 12.73 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 116.865 -0.152 . . . . 0.0 111.334 177.486 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.438 ' HB3' HG23 ' A' ' 79' ' ' VAL . 75.0 m-85 -132.86 -43.98 0.88 Allowed 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -175.657 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 45.5 mm -77.0 -36.59 25.2 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 CA-C-O 120.698 0.285 . . . . 0.0 111.691 -173.643 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.505 ' HB2' ' HA ' ' A' ' 68' ' ' GLU . 60.0 tp60 -59.25 133.66 56.3 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.829 -175.194 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 37.1 p -61.95 124.06 19.74 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.017 177.684 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 26.9 t70 70.99 29.9 2.88 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.117 -178.597 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.442 ' HB1' ' HD2' ' A' ' 76' ' ' PRO . . . -63.65 164.91 13.71 Favored Pre-proline 0 CA--C 1.537 0.445 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.724 171.682 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.442 ' HD2' ' HB1' ' A' ' 75' ' ' ALA . 84.7 Cg_exo -45.18 -57.61 2.02 Favored 'Trans proline' 0 C--N 1.356 0.955 0 C-N-CA 122.499 2.133 . . . . 0.0 111.915 178.834 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.1 72.66 1.47 Allowed 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 171.736 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -68.05 146.76 53.2 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.184 -178.289 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.479 HG11 HG22 ' A' ' 108' ' ' VAL . 53.5 t -85.02 147.05 5.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 176.982 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 46.7 m-80 -77.86 51.8 0.98 Allowed 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 121.606 0.717 . . . . 0.0 110.151 177.723 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.407 HD11 HG21 ' A' ' 85' ' ' THR . 44.8 tp -73.79 147.22 43.62 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.001 -0.999 . . . . 0.0 110.351 178.863 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -50.34 139.98 14.24 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.431 178.724 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 47.8 p90 -64.79 -37.35 87.33 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.945 -176.26 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.421 ' O ' ' HB3' ' A' ' 87' ' ' GLU . 72.4 t60 -69.16 -36.61 77.59 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.81 0.338 . . . . 0.0 110.379 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.407 HG21 HD11 ' A' ' 81' ' ' LEU . 38.7 m -66.86 -43.99 82.14 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.121 176.831 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.446 ' O ' HG23 ' A' ' 90' ' ' THR . 95.7 mttt -60.82 -38.56 85.85 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 174.831 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.421 ' HB3' ' O ' ' A' ' 84' ' ' HIS . 43.2 tt0 -56.52 -50.19 72.56 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.41 177.719 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.413 HG23 ' O ' ' A' ' 84' ' ' HIS . 96.2 t -62.42 -51.15 75.85 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.797 179.079 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 71.4 mt -57.73 -49.29 81.29 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.273 -176.954 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.446 HG23 ' O ' ' A' ' 86' ' ' LYS . 49.1 p -57.66 -39.98 78.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.166 0.507 . . . . 0.0 111.083 -178.473 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 32.9 m-80 -85.61 -4.87 59.28 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.983 -176.867 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 15.3 m -124.88 0.84 8.04 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.7 tp -66.63 -23.01 30.6 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 CA-C-O 120.761 0.315 . . . . 0.0 111.459 -174.006 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.554 HG23 ' HG2' ' A' ' 95' ' ' GLN . 15.4 t -63.03 -25.31 68.32 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.981 179.298 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.554 ' HG2' HG23 ' A' ' 94' ' ' THR . 11.4 pt20 -151.83 77.25 7.11 Favored Pre-proline 0 CA--C 1.536 0.412 0 CA-C-O 121.236 0.541 . . . . 0.0 110.503 179.596 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.475 ' HG2' HG22 ' A' ' 59' ' ' ILE . 96.4 Cg_endo -88.69 159.31 6.32 Favored 'Trans proline' 0 N--CA 1.461 -0.418 0 C-N-CA 122.768 2.312 . . . . 0.0 112.214 179.134 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.485 ' H ' ' HB2' ' A' ' 100' ' ' SER . 18.5 p -96.3 172.28 8.05 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.938 176.355 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 10.4 mp -53.29 -30.32 38.07 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 -174.029 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -133.2 31.71 3.79 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.907 0.384 . . . . 0.0 110.513 -176.458 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' SER . . . . . 0.485 ' HB2' ' H ' ' A' ' 97' ' ' THR . 23.5 t -54.68 -26.02 30.8 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.82 -177.321 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -83.68 17.9 2.11 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.438 -178.703 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -56.94 -50.13 73.53 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.917 0.389 . . . . 0.0 110.965 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.7 -47.97 83.53 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.671 179.074 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.404 ' O ' HG23 ' A' ' 108' ' ' VAL . . . -60.52 -36.81 79.29 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.532 178.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.656 ' HG3' ' HB2' ' A' ' 44' ' ' TRP . 57.3 tt0 -57.29 -44.16 83.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.185 -179.246 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 14.4 m -69.36 -41.72 76.2 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.762 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' ARG . . . . . 0.483 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 38.4 mmt180 -60.03 -43.94 94.98 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.365 -178.119 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.479 HG22 HG11 ' A' ' 79' ' ' VAL . 83.4 t -69.22 -43.4 81.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.95 0.405 . . . . 0.0 111.068 -177.655 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 25.0 t80 -56.8 -46.22 81.73 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.376 179.293 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.483 ' HG3' ' O ' ' A' ' 107' ' ' ARG . 5.3 pp0? -70.11 -36.46 74.86 Favored 'General case' 0 C--O 1.238 0.485 0 N-CA-C 111.677 0.251 . . . . 0.0 111.677 -175.819 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.484 ' HA ' ' HG2' ' A' ' 114' ' ' GLN . 4.5 pp -74.0 -28.05 61.26 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 120.815 -0.354 . . . . 0.0 110.269 179.415 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 112' ' ' MET . . . . . 0.513 ' HE1' ' HA ' ' A' ' 41' ' ' ILE . 44.2 ttm -61.89 -39.63 92.61 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.563 175.162 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 113' ' ' GLU . . . . . 0.455 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 3.2 tm-20 -59.79 -60.88 3.13 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.624 -0.717 . . . . 0.0 110.164 177.56 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 114' ' ' GLN . . . . . 0.484 ' HG2' ' HA ' ' A' ' 111' ' ' LEU . 13.7 pt20 -64.63 -18.13 64.65 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -173.072 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -110.28 -67.27 1.0 Allowed 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.138 0.494 . . . . 0.0 111.71 -179.542 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 17.4 m -72.5 -31.45 65.37 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.696 -172.589 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' TYR . . . . . 0.497 ' CE1' HD22 ' A' ' 18' ' ' LEU . 18.3 t80 -81.72 -36.91 28.09 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.175 -0.61 . . . . 0.0 110.924 -177.602 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 22.0 p -60.04 -47.49 85.65 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-O 120.905 0.384 . . . . 0.0 110.45 178.353 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 14.7 ptp180 -61.49 -36.07 79.44 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 176.025 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -65.56 -33.84 76.85 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.557 177.343 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 86.3 mt -65.15 -28.69 69.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.028 0.442 . . . . 0.0 110.196 176.736 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 3.7 tppp? -93.44 -9.86 37.08 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.379 179.157 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 60.7 p -59.85 146.84 40.52 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-O 121.153 0.501 . . . . 0.0 111.578 -176.301 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -59.73 -38.03 80.56 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.173 179.31 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.456 ' O ' ' HG ' ' A' ' 129' ' ' LEU . 0.0 OUTLIER -64.49 -47.04 90.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.66 -176.922 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -66.38 -48.35 70.4 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 120.877 0.37 . . . . 0.0 111.132 -177.827 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 95.5 mt -63.37 -29.59 70.87 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.871 -179.576 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -67.79 -39.23 84.04 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.668 177.079 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 125' ' ' ILE . 97.8 mt -61.15 -47.86 84.24 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.988 -179.103 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 130' ' ' MET . . . . . 0.411 ' HG3' ' N ' ' A' ' 131' ' ' GLU . 14.8 ptp -76.06 -41.02 51.97 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.249 -178.846 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 131' ' ' GLU . . . . . 0.411 ' N ' ' HG3' ' A' ' 130' ' ' MET . 38.8 tt0 62.77 -72.21 0.05 OUTLIER 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 123.375 0.67 . . . . 0.0 110.747 -175.967 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 168.4 -52.94 0.22 Allowed Glycine 0 N--CA 1.449 -0.49 0 N-CA-C 110.899 -0.88 . . . . 0.0 110.899 -178.415 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -171.85 100.9 0.38 Allowed Pre-proline 0 CA--C 1.535 0.398 0 C-N-CA 122.756 0.423 . . . . 0.0 110.849 177.48 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo . . . . . 0 C--N 1.348 0.542 0 C-N-CA 123.222 2.614 . . . . 0.0 112.43 177.581 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 23.9 t . . . . . 0 N--CA 1.479 0.983 0 CA-C-O 120.804 0.335 . . . . 0.0 110.557 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 23.8 ptm -103.65 118.21 36.2 Favored 'General case' 0 C--O 1.234 0.257 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 175.826 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 6.8 p -165.49 151.64 2.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.89 0.376 . . . . 0.0 111.56 -176.541 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 17.3 m -100.17 148.19 34.54 Favored Pre-proline 0 CA--C 1.535 0.383 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.743 175.712 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo -49.27 -44.22 34.68 Favored 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 123.057 2.505 . . . . 0.0 113.232 -177.739 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.439 ' HA ' HG22 ' A' ' 9' ' ' VAL . 32.6 mt-10 -70.61 -24.38 62.73 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.222 -177.175 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.404 ' O ' ' HB3' ' A' ' 10' ' ' LYS . 21.2 tp10 -73.21 -34.33 65.88 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 173.187 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.745 ' HB3' ' SD ' ' A' ' 130' ' ' MET . . . -66.68 -42.22 86.85 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.048 179.789 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.439 HG22 ' HA ' ' A' ' 6' ' ' GLU . 27.1 m -68.26 -25.69 32.2 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 CA-C-O 120.971 0.415 . . . . 0.0 110.195 175.594 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.404 ' HB3' ' O ' ' A' ' 7' ' ' GLU . 16.9 tppt? -69.58 -27.86 65.48 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.007 174.074 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 46.8 m0 -72.15 -35.27 69.02 Favored 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 171.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -69.0 -2.64 32.03 Favored Glycine 0 N--CA 1.452 -0.298 0 CA-C-N 115.15 -0.932 . . . . 0.0 113.568 -176.882 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -115.42 4.44 14.33 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 117.048 0.424 . . . . 0.0 110.507 176.778 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.1 p -161.46 92.95 0.91 Allowed 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 121.039 0.447 . . . . 0.0 111.101 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.413 ' CE1' HD23 ' A' ' 18' ' ' LEU . 13.1 t80 -58.27 -38.6 77.28 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.007 177.851 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -48.88 -42.07 35.47 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.389 173.653 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -76.12 -27.37 57.05 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.26 -178.473 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.413 HD23 ' CE1' ' A' ' 15' ' ' PHE . 52.8 tp -59.15 -43.27 92.04 Favored 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 110.054 -0.35 . . . . 0.0 110.054 179.008 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -75.31 -32.02 60.84 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.374 176.547 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 43.3 t -61.72 -35.3 77.64 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.476 178.093 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -80.56 115.08 19.89 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 177.195 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.31 -44.3 54.05 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 121.254 0.549 . . . . 0.0 110.583 177.084 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -72.39 -28.23 62.86 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.827 -178.507 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -71.01 -44.83 54.2 Favored Glycine 0 N--CA 1.451 -0.324 0 N-CA-C 111.063 -0.815 . . . . 0.0 111.063 177.084 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.3 tt -62.57 -41.46 98.95 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.923 -0.639 . . . . 0.0 110.481 177.575 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.498 ' O ' ' HG2' ' A' ' 30' ' ' ARG . 43.6 tt0 -58.84 -47.84 83.43 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.876 0.37 . . . . 0.0 110.211 177.473 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -63.61 -40.86 98.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.963 0.411 . . . . 0.0 110.78 179.241 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 73.2 t80 -64.53 -45.4 87.36 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.071 -177.202 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.531 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 9.7 t -66.54 -41.67 88.35 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 120.91 -0.316 . . . . 0.0 110.558 -179.451 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.498 ' HG2' ' O ' ' A' ' 26' ' ' GLU . 12.1 mmt180 -54.1 -36.01 62.76 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 120.994 0.426 . . . . 0.0 110.395 178.651 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.454 ' O ' HG22 ' A' ' 34' ' ' THR . 63.4 t80 -70.62 -53.73 14.76 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.543 175.579 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 28.2 tp -64.07 -24.1 67.58 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.91 -173.181 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.531 ' HG3' ' O ' ' A' ' 29' ' ' THR . 68.5 mttm -65.02 -14.05 59.43 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 116.749 -0.205 . . . . 0.0 111.336 179.58 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.454 HG22 ' O ' ' A' ' 31' ' ' PHE . 14.3 t -62.82 -34.51 77.46 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 120.851 0.358 . . . . 0.0 110.7 179.275 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -115.76 7.94 14.75 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.13 -175.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 92.5 m-85 59.54 17.09 5.79 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 115.942 -0.572 . . . . 0.0 112.542 173.595 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 8.4 t -86.86 27.57 0.99 Allowed 'General case' 0 C--O 1.235 0.3 0 CA-C-O 121.63 0.729 . . . . 0.0 109.638 -179.16 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 64.6 tt0 -71.83 -13.62 61.73 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.956 -177.177 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.469 ' HB3' ' HB3' ' A' ' 77' ' ' LYS . 0.8 OUTLIER -55.74 -26.61 46.39 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 111.704 0.261 . . . . 0.0 111.704 -178.354 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.411 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 57.3 m-80 -61.65 -50.15 73.68 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-O 121.625 0.726 . . . . 0.0 109.944 173.883 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 61.7 mt -63.5 -49.72 81.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.935 178.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -57.96 -30.87 66.35 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.805 177.998 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.411 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 79.1 t80 -58.69 -63.23 1.36 Allowed 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.502 179.733 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.581 ' HA ' ' SG ' ' A' ' 47' ' ' CYS . 6.2 p-90 -79.05 -5.99 55.34 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 119.545 -0.862 . . . . 0.0 112.148 -178.778 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 8.8 mt -69.37 -45.88 77.91 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 166.335 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.45 -32.04 73.49 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.326 177.266 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.581 ' SG ' ' HA ' ' A' ' 44' ' ' TRP . 73.6 m -64.35 -30.72 71.76 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.801 177.965 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.463 ' HG3' ' HE3' ' A' ' 51' ' ' LYS . 39.8 tt0 -77.0 -40.86 45.14 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 178.011 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -61.44 -31.64 71.59 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 121.525 0.679 . . . . 0.0 109.671 173.531 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.462 ' CZ ' HG23 ' A' ' 59' ' ' ILE . 56.4 t80 -65.36 -52.67 52.12 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 114.911 -1.04 . . . . 0.0 111.162 178.709 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.463 ' HE3' ' HG3' ' A' ' 48' ' ' GLU . 0.0 OUTLIER -68.87 -21.49 64.26 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 121.347 0.594 . . . . 0.0 110.028 179.749 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 8.8 tttm -69.68 -19.71 63.58 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.271 173.363 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 15.5 m -84.29 43.66 0.97 Allowed 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.517 179.041 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.19 98.47 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.678 0.752 . . . . 0.0 112.407 -177.477 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLY . . . . . 0.515 ' O ' HG12 ' A' ' 59' ' ' ILE . . . -179.91 129.15 1.3 Allowed Glycine 0 C--O 1.226 -0.392 0 N-CA-C 110.624 -0.99 . . . . 0.0 110.624 176.943 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_endo -46.29 -58.23 1.79 Allowed 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.951 2.434 . . . . 0.0 112.997 -172.554 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -71.16 -38.15 72.19 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 120.978 0.418 . . . . 0.0 110.543 -178.566 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.585 ' OE1' HD11 ' A' ' 61' ' ' LEU . 5.4 tp-100 -57.46 -42.31 82.32 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.489 -178.357 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.515 HG12 ' O ' ' A' ' 55' ' ' GLY . 36.9 mm -58.46 -47.12 89.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.312 -178.69 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 13.1 m80 -64.76 -46.04 83.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.277 -174.499 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.585 HD11 ' OE1' ' A' ' 58' ' ' GLN . 4.5 pp -71.59 -33.23 68.86 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.127 -176.928 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.476 ' N ' HD12 ' A' ' 61' ' ' LEU . 12.3 mmmm -68.55 -42.67 78.05 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 110.095 -0.335 . . . . 0.0 110.095 176.061 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.22 -39.48 90.41 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.372 177.305 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.478 ' O ' ' HB3' ' A' ' 67' ' ' TYR . 4.0 tmtp? -65.3 -38.22 89.53 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.898 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -65.36 -49.85 67.78 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.137 0.494 . . . . 0.0 110.303 177.471 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 70.8 mt -61.66 -30.65 48.74 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.069 177.128 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.542 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 78.2 t80 -58.85 -58.32 9.14 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.494 178.334 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -70.09 -26.65 64.08 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.88 -0.6 . . . . 0.0 112.095 -172.61 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 35.2 ttpt -99.87 -28.31 13.18 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 -174.905 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -120.27 -45.27 2.45 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -176.266 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.542 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 44.2 mm -76.64 -22.6 15.12 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 CA-C-O 120.573 0.225 . . . . 0.0 110.984 -173.852 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.502 ' HG3' ' H ' ' A' ' 74' ' ' ASP . 6.3 tp60 -50.54 148.18 4.02 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.735 176.601 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 26.1 m -57.48 -42.85 83.47 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.267 -179.629 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.502 ' H ' ' HG3' ' A' ' 72' ' ' GLN . 6.7 m-20 -82.88 -72.4 0.45 Allowed 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.281 -179.44 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . 69.24 134.71 0.04 OUTLIER Pre-proline 0 CA--C 1.535 0.403 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.761 -177.836 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -59.33 -35.76 96.05 Favored 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 122.587 2.191 . . . . 0.0 112.044 -178.39 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.469 ' HB3' ' HB3' ' A' ' 39' ' ' GLU . 14.1 mmmm -87.88 -15.61 36.24 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.575 178.964 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 58.73 83.14 0.13 Allowed 'General case' 0 C--O 1.236 0.387 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.018 -177.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.447 HG12 ' H ' ' A' ' 81' ' ' LEU . 35.9 t -80.93 140.74 16.18 Favored 'Isoleucine or valine' 0 C--O 1.234 0.275 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.48 -176.679 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -88.54 11.26 17.7 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.118 -0.492 . . . . 0.0 112.025 -172.976 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.49 HD11 HG21 ' A' ' 85' ' ' THR . 25.7 tp -59.15 145.0 44.09 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -175.336 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.455 ' O ' ' HG3' ' A' ' 86' ' ' LYS . 10.9 t70 -55.64 145.33 23.92 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 115.044 -0.98 . . . . 0.0 112.543 -177.76 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 45.7 p90 -67.3 -42.46 83.69 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.812 -175.876 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.492 ' O ' ' HB3' ' A' ' 87' ' ' GLU . 69.4 t60 -69.15 -29.51 67.56 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.898 0.38 . . . . 0.0 110.341 -177.849 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.536 ' OG1' ' HG3' ' A' ' 107' ' ' ARG . 22.1 m -67.15 -45.97 75.48 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 176.589 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.455 ' HG3' ' O ' ' A' ' 82' ' ' ASP . 26.3 mtpp -56.65 -39.08 73.08 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 109.26 -0.645 . . . . 0.0 109.26 175.24 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.492 ' HB3' ' O ' ' A' ' 84' ' ' HIS . 56.1 tt0 -58.18 -53.83 53.89 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.601 177.639 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 84' ' ' HIS . 96.9 t -55.14 -43.2 69.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.071 0.462 . . . . 0.0 110.312 179.446 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.405 HG13 ' O ' ' A' ' 85' ' ' THR . 73.9 mt -65.25 -42.43 93.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.091 -179.394 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 41.1 p -64.38 -18.39 64.63 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 120.93 0.395 . . . . 0.0 111.031 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 47.6 m-80 -88.85 -41.56 12.4 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.564 174.472 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 22.8 t -87.83 0.54 55.66 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.572 -174.74 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 8.9 tp -57.12 -29.1 31.04 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.383 0 CA-C-O 120.945 0.402 . . . . 0.0 111.143 -179.243 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 9.0 t -68.27 -33.88 75.17 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.826 179.406 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 75.5 mm-40 -139.25 80.32 23.49 Favored Pre-proline 0 C--O 1.234 0.276 0 CA-C-O 120.988 0.423 . . . . 0.0 110.955 -178.067 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.498 ' HG2' HG22 ' A' ' 59' ' ' ILE . 89.5 Cg_endo -85.72 133.63 4.42 Favored 'Trans proline' 0 N--CA 1.46 -0.461 0 C-N-CA 122.685 2.257 . . . . 0.0 111.774 174.36 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.435 ' N ' ' HB2' ' A' ' 100' ' ' SER . 9.5 p -83.22 176.2 9.35 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.71 176.676 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.439 ' H ' HD22 ' A' ' 98' ' ' LEU . 3.4 mm? -52.14 -45.98 65.2 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.042 0.448 . . . . 0.0 111.229 -175.108 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 7.7 t-80 -116.78 31.85 6.5 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.754 -176.58 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' SER . . . . . 0.435 ' HB2' ' N ' ' A' ' 97' ' ' THR . 20.8 t -45.87 -40.09 9.51 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.633 -0.712 . . . . 0.0 112.683 -172.797 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 -76.04 16.5 0.42 Allowed 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 112.001 0.371 . . . . 0.0 112.001 -177.131 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -58.47 -46.99 85.48 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 121.08 0.466 . . . . 0.0 110.786 178.746 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.409 ' O ' ' HG2' ' A' ' 107' ' ' ARG . . . -58.78 -42.89 90.06 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.403 178.568 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.0 -36.71 85.28 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.649 179.54 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 19.9 tm0? -57.56 -51.44 69.48 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.419 177.327 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' SER . . . . . 0.659 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 31.4 t -57.3 -48.55 78.64 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.211 179.655 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' ARG . . . . . 0.536 ' HG3' ' OG1' ' A' ' 85' ' ' THR . 24.9 mmt180 -53.42 -54.85 30.93 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.317 -179.337 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.527 ' HA ' HD12 ' A' ' 111' ' ' LEU . 98.7 t -60.16 -40.21 82.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.563 -179.604 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 109' ' ' TYR . . . . . 0.599 ' HA ' ' SD ' ' A' ' 112' ' ' MET . 28.5 t80 -57.25 -41.21 79.18 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.147 178.718 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.659 ' HG3' ' O ' ' A' ' 106' ' ' SER . 48.9 mt-30 -63.46 -39.94 95.81 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 121.55 0.69 . . . . 0.0 109.816 178.659 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.535 ' HG ' ' O ' ' A' ' 107' ' ' ARG . 93.9 mt -59.33 -49.11 79.09 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 114.581 -1.191 . . . . 0.0 111.934 -173.16 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 112' ' ' MET . . . . . 0.599 ' SD ' ' HA ' ' A' ' 109' ' ' TYR . 0.0 OUTLIER -91.07 -5.62 54.95 Favored 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 120.364 -0.534 . . . . 0.0 110.956 -179.188 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 113' ' ' GLU . . . . . 0.632 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 42.3 tt0 -69.97 -66.43 0.59 Allowed 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 174.496 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 28.3 pt20 -51.85 -31.73 29.06 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.579 -177.825 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -98.65 -72.15 0.66 Allowed 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.653 -177.003 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 14.4 m -71.27 -31.46 67.52 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -168.772 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' TYR . . . . . 0.632 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 15.7 t80 -64.48 -57.34 9.5 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 117.829 0.286 . . . . 0.0 110.633 -178.55 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 39.5 p -60.09 -46.65 88.88 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 121.372 0.606 . . . . 0.0 110.327 179.1 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 20.5 ttp85 -61.0 -31.3 70.91 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.831 178.633 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 86.0 t80 -70.87 -39.73 72.71 Favored 'General case' 0 C--O 1.225 -0.218 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 177.09 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 87.9 mt -62.34 -22.53 66.15 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.932 0.396 . . . . 0.0 110.403 178.023 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -101.44 -11.98 18.93 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.998 177.299 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 82.7 p -65.44 144.59 56.96 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 120.662 0.268 . . . . 0.0 111.013 -175.322 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -57.62 -31.14 65.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.214 177.076 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 2.3 mp -52.71 -53.18 21.99 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 CA-C-O 121.298 0.57 . . . . 0.0 110.254 175.62 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -61.91 -48.3 81.09 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.597 -178.114 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.477 ' HA ' ' HB2' ' A' ' 130' ' ' MET . 3.9 mm? -68.05 -20.35 64.97 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.106 -179.507 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -76.92 -26.27 53.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.065 0.46 . . . . 0.0 110.192 177.154 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 70.8 mt -82.49 -34.86 27.85 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 107.268 -1.382 . . . . 0.0 107.268 175.772 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 130' ' ' MET . . . . . 0.745 ' SD ' ' HB3' ' A' ' 8' ' ' ALA . 83.2 mmm -82.67 -165.24 1.0 Allowed 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 113.272 -1.785 . . . . 0.0 110.656 178.66 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -162.34 -34.09 0.04 OUTLIER 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 114.723 -1.126 . . . . 0.0 109.805 -177.578 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 124.7 55.78 0.18 Allowed Glycine 0 N--CA 1.45 -0.382 0 CA-C-N 116.138 -0.483 . . . . 0.0 112.575 175.627 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' ARG . . . . . 0.465 ' HA ' ' NE ' ' A' ' 133' ' ' ARG . 1.4 tpm_? -128.58 83.24 66.76 Favored Pre-proline 0 CA--C 1.531 0.25 0 CA-C-N 116.983 0.392 . . . . 0.0 110.776 175.708 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo . . . . . 0 N--CA 1.459 -0.51 0 C-N-CA 123.099 2.533 . . . . 0.0 111.727 175.291 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 49.0 m . . . . . 0 N--CA 1.477 0.908 0 CA-C-O 120.706 0.289 . . . . 0.0 110.698 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 45.3 ttp -135.98 20.19 3.25 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.597 0.713 . . . . 0.0 109.639 -179.373 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.474 HG23 ' HB3' ' A' ' 7' ' ' GLU . 1.5 p -62.56 120.5 9.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.349 177.141 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 45.1 t -80.73 154.46 73.39 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.536 175.538 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_endo -48.12 -36.64 29.0 Favored 'Trans proline' 0 C--N 1.353 0.773 0 C-N-CA 122.701 2.268 . . . . 0.0 112.108 176.188 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.501 ' O ' ' HG2' ' A' ' 10' ' ' LYS . 33.5 mt-10 -70.28 -32.36 70.13 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 121.282 0.563 . . . . 0.0 110.543 178.421 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.474 ' HB3' HG23 ' A' ' 3' ' ' VAL . 18.9 tp10 -71.99 -32.63 67.4 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 176.583 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.94 -46.53 84.3 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.855 178.553 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.458 HG22 ' O ' ' A' ' 6' ' ' GLU . 19.8 m -66.45 -26.65 38.17 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.23 0 C-N-CA 121.054 -0.258 . . . . 0.0 110.491 179.026 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.501 ' HG2' ' O ' ' A' ' 6' ' ' GLU . 74.2 mmtt -62.81 -44.32 96.46 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.952 0.406 . . . . 0.0 110.016 172.334 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 39.0 m0 -64.49 -27.61 69.1 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.27 0.557 . . . . 0.0 109.863 176.615 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -76.99 -14.51 82.56 Favored Glycine 0 N--CA 1.449 -0.499 0 CA-C-N 115.326 -0.852 . . . . 0.0 112.647 178.47 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -69.84 -50.83 38.88 Favored 'General case' 0 CA--C 1.521 -0.173 0 CA-C-O 121.203 0.525 . . . . 0.0 110.279 178.129 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 28.6 m -152.45 134.07 14.61 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.602 -175.073 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.43 ' CE1' HD23 ' A' ' 18' ' ' LEU . 1.7 t80 -60.29 -35.06 74.71 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.478 -178.205 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -65.03 -32.98 74.97 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.459 179.874 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 4.3 ttmp? -65.95 -38.46 88.64 Favored 'General case' 0 N--CA 1.464 0.253 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 177.146 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.43 HD23 ' CE1' ' A' ' 15' ' ' PHE . 56.5 tp -58.22 -46.81 85.2 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.947 174.677 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.418 ' HG ' ' HH2' ' A' ' 44' ' ' TRP . 6.7 mp -62.77 -37.56 87.14 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.191 177.631 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 52.4 m -73.06 -11.7 60.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.341 -177.531 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -98.26 114.18 26.37 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 179.549 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 10.7 mmt85 -50.27 -48.53 54.78 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.091 0.472 . . . . 0.0 111.129 177.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -69.25 -19.25 63.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.511 -179.652 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -80.47 -44.67 8.47 Favored Glycine 0 C--N 1.334 0.436 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.594 178.536 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.41 HD11 HD12 ' A' ' 45' ' ' ILE . 7.1 tp -50.51 -51.66 45.49 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.542 0.686 . . . . 0.0 109.913 173.2 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.431 ' O ' ' HG3' ' A' ' 30' ' ' ARG . 9.0 tp10 -58.93 -52.99 63.36 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.603 -1.18 . . . . 0.0 110.703 -178.965 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -58.38 -39.54 79.9 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.993 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -67.11 -49.26 65.55 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.801 -178.487 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.501 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 14.6 t -66.2 -36.68 83.7 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 110.363 -0.236 . . . . 0.0 110.363 -177.254 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.431 ' HG3' ' O ' ' A' ' 26' ' ' GLU . 62.9 mtp180 -57.52 -41.9 81.75 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 120.888 0.375 . . . . 0.0 110.513 176.889 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.568 ' O ' HG22 ' A' ' 34' ' ' THR . 51.3 t80 -72.64 -43.79 62.74 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.453 176.621 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.489 HD21 ' OD1' ' A' ' 40' ' ' ASN . 19.4 tp -62.08 -28.56 69.7 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.184 -174.975 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.573 ' HG2' ' HB3' ' A' ' 38' ' ' GLU . 99.2 mttt -79.78 -4.87 53.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.534 -179.583 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.568 HG22 ' O ' ' A' ' 31' ' ' PHE . 1.0 OUTLIER -84.62 -17.74 37.7 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 176.039 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -113.44 0.73 14.83 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.747 177.566 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 48.0 t80 68.28 16.79 9.33 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.804 174.708 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 31.7 m -85.28 9.17 16.03 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 121.099 0.476 . . . . 0.0 110.327 177.099 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.573 ' HB3' ' HG2' ' A' ' 33' ' ' LYS . 10.0 pt-20 -56.31 -19.31 13.76 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.429 -0.805 . . . . 0.0 112.454 -177.515 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -50.04 -37.92 35.46 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.341 -179.744 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.536 ' ND2' ' HB3' ' A' ' 112' ' ' MET . 28.6 p30 -81.23 -39.04 25.98 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-N 115.934 -0.576 . . . . 0.0 112.224 -172.272 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.454 HG22 ' O ' ' A' ' 38' ' ' GLU . 9.8 tp -65.8 -43.64 93.26 Favored 'Isoleucine or valine' 0 C--O 1.234 0.254 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 -179.419 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.41 ' HA ' HG22 ' A' ' 45' ' ' ILE . 0.6 OUTLIER -66.32 -31.8 72.81 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.735 176.359 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.424 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 81.7 t80 -55.11 -70.19 0.11 Allowed 'General case' 0 C--O 1.238 0.491 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.558 179.805 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.418 ' HH2' ' HG ' ' A' ' 19' ' ' LEU . 28.4 p-90 -81.72 -15.82 53.15 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 119.854 -0.738 . . . . 0.0 112.67 -171.418 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.41 HD12 HD11 ' A' ' 25' ' ' LEU . 10.8 tt -67.13 -35.76 75.15 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 173.451 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.49 -36.64 83.24 Favored 'General case' 0 N--CA 1.456 -0.128 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.574 173.546 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 72.8 m -66.32 -24.62 66.56 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.075 176.678 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.528 ' HA ' ' HB2' ' A' ' 51' ' ' LYS . 12.6 mm-40 -83.37 -22.87 32.67 Favored 'General case' 0 C--O 1.233 0.218 0 O-C-N 122.272 -0.268 . . . . 0.0 110.556 175.644 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.426 ' HA ' ' HG2' ' A' ' 52' ' ' LYS . 24.5 t70 -68.06 -42.56 80.28 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 168.327 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.423 ' CE1' HG23 ' A' ' 59' ' ' ILE . 6.3 t80 -57.02 -32.87 66.61 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.711 -1.132 . . . . 0.0 110.197 170.282 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.528 ' HB2' ' HA ' ' A' ' 48' ' ' GLU . 0.0 OUTLIER -73.45 -40.42 64.19 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.297 -176.905 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.426 ' HG2' ' HA ' ' A' ' 49' ' ' ASP . 7.0 ptmm? -74.78 -26.63 59.88 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 120.579 0.228 . . . . 0.0 111.154 179.667 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 28.8 p -77.84 67.34 3.69 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-O 121.174 0.512 . . . . 0.0 109.691 175.412 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.491 ' NZ ' ' HB2' ' A' ' 54' ' ' LYS . 0.0 OUTLIER -77.08 16.96 0.49 Allowed 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.387 -0.824 . . . . 0.0 113.162 -170.937 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -68.94 133.78 27.06 Favored Glycine 0 CA--C 1.52 0.398 0 C-N-CA 120.451 -0.881 . . . . 0.0 110.937 176.052 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -54.21 -42.1 70.25 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.729 2.286 . . . . 0.0 112.642 -174.177 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -89.07 -29.1 19.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.17 0.51 . . . . 0.0 109.908 179.005 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.489 ' OE1' HD11 ' A' ' 61' ' ' LEU . 4.7 tp-100 -56.23 -42.25 76.99 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.714 178.296 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.423 HG23 ' CE1' ' A' ' 50' ' ' PHE . 29.9 mm -54.58 -39.6 46.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.308 178.295 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 21.9 m80 -66.02 -52.06 52.67 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.185 -175.903 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.489 HD11 ' OE1' ' A' ' 58' ' ' GLN . 4.6 pp -69.74 -32.21 70.62 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.964 -177.459 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.489 ' N ' HD12 ' A' ' 61' ' ' LEU . 66.6 mmtt -66.69 -43.65 83.83 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 121.174 0.512 . . . . 0.0 109.997 174.91 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.22 -47.54 85.55 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.952 -179.797 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 3.5 tppp? -63.66 -35.37 80.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.502 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.83 -53.27 59.9 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.048 0.451 . . . . 0.0 110.401 177.661 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 65.5 mt -62.9 -37.62 79.71 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.392 178.154 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.549 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 71.9 t80 -57.21 -56.87 16.22 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.735 -179.487 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.458 ' HA ' ' HG2' ' A' ' 72' ' ' GLN . 42.8 mt-10 -70.69 -30.09 66.57 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.529 -175.203 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 58.2 tttm -90.9 -19.04 23.78 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.723 -173.581 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 99.4 m-85 -136.35 -53.2 0.73 Allowed 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -176.052 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.549 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 45.7 mm -73.1 -24.09 20.58 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -167.433 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.458 ' HG2' ' HA ' ' A' ' 68' ' ' GLU . 13.5 mm-40 -53.67 139.88 30.91 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 120.851 0.358 . . . . 0.0 111.244 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 65.2 m -71.97 69.68 0.73 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.609 0.719 . . . . 0.0 110.089 176.25 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 21.2 t70 170.59 -76.69 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 107.406 -1.331 . . . . 0.0 107.406 -178.274 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.406 ' HA ' ' HD3' ' A' ' 76' ' ' PRO . . . 59.95 149.07 0.08 OUTLIER Pre-proline 0 CA--C 1.538 0.493 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 169.622 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 75' ' ' ALA . 21.3 Cg_exo -67.43 -20.07 48.5 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 122.508 2.139 . . . . 0.0 111.625 173.815 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.757 ' HA ' ' HE2' ' A' ' 77' ' ' LYS . 11.2 mmpt? -105.25 -19.7 13.73 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.149 -179.379 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 52.19 77.98 0.14 Allowed 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 121.317 0.58 . . . . 0.0 110.082 -175.704 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 59.0 t -84.94 117.52 30.35 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.95 -175.605 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -80.23 77.39 6.97 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.35 0.595 . . . . 0.0 110.35 179.261 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 20.5 tp -110.75 148.06 33.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.891 176.883 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -49.57 128.61 17.92 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.285 -178.271 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.412 ' O ' ' HG2' ' A' ' 86' ' ' LYS . 38.2 p90 -52.19 -42.78 63.79 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.412 -179.78 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.442 ' O ' HG23 ' A' ' 88' ' ' VAL . 68.7 t60 -68.07 -39.7 82.91 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.674 -0.239 . . . . 0.0 110.88 -178.385 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 40.6 m -63.71 -46.49 85.24 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.917 0.389 . . . . 0.0 110.547 -179.26 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.412 ' HG2' ' O ' ' A' ' 83' ' ' PHE . 12.0 ptmm? -72.12 -21.95 61.4 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.153 179.688 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -69.92 -46.54 65.14 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.227 174.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 84' ' ' HIS . 87.6 t -54.84 -36.98 39.3 Favored 'Isoleucine or valine' 0 C--O 1.235 0.32 0 CA-C-O 121.287 0.565 . . . . 0.0 109.61 175.242 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.409 HD12 ' HA ' ' A' ' 86' ' ' LYS . 74.4 mt -63.15 -46.48 95.84 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.71 176.304 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 72.1 p -63.94 -22.57 66.98 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.067 0.46 . . . . 0.0 111.094 -179.215 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 79.6 m-20 -85.6 -31.1 22.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.542 178.715 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 20.7 m -98.2 -1.84 41.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.469 -176.913 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 11.0 tp -66.33 -15.01 18.47 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 CA-C-O 121.106 0.479 . . . . 0.0 111.238 -176.839 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 8.0 t -89.3 -6.95 56.31 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.909 178.487 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.489 ' N ' ' HD3' ' A' ' 96' ' ' PRO . 25.5 pt20 -160.79 56.92 0.81 Allowed Pre-proline 0 CA--C 1.536 0.43 0 CA-C-O 120.973 0.416 . . . . 0.0 110.495 -179.132 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.489 ' HD3' ' N ' ' A' ' 95' ' ' GLN . 23.9 Cg_exo -63.06 134.19 44.82 Favored 'Trans proline' 0 C--N 1.351 0.698 0 C-N-CA 122.798 2.332 . . . . 0.0 112.501 -174.4 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.449 ' H ' ' HB2' ' A' ' 100' ' ' SER . 52.7 p -90.87 168.84 11.41 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.434 176.454 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 34.9 tp -55.54 -47.1 76.85 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 120.972 0.415 . . . . 0.0 111.151 -177.538 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' HIS . . . . . 0.445 ' HB3' ' HB2' ' A' ' 102' ' ' ASP . 45.9 m-70 -108.67 36.98 2.65 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.818 0.342 . . . . 0.0 110.492 178.558 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' SER . . . . . 0.449 ' HB2' ' H ' ' A' ' 97' ' ' THR . 15.6 t -59.22 -48.98 79.61 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.064 0.459 . . . . 0.0 110.511 178.341 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.476 ' O ' ' HG3' ' A' ' 105' ' ' GLN . 84.3 m-85 -80.21 -1.52 40.91 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.591 -177.934 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ASP . . . . . 0.445 ' HB2' ' HB3' ' A' ' 99' ' ' HIS . 16.1 t70 -52.88 -42.71 65.54 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 120.993 0.425 . . . . 0.0 110.608 -176.875 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.58 ' O ' ' HG2' ' A' ' 107' ' ' ARG . . . -57.22 -51.31 69.85 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.464 176.699 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.69 -40.18 87.02 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.979 -179.314 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.476 ' HG3' ' O ' ' A' ' 101' ' ' PHE . 25.9 mt-30 -60.63 -43.86 97.04 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.921 178.645 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 25.8 t -62.23 -37.43 85.38 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.605 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' ARG . . . . . 0.58 ' HG2' ' O ' ' A' ' 103' ' ' ALA . 16.3 mmm180 -65.42 -60.53 2.86 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.051 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 53.7 t -53.46 -40.66 41.82 Favored 'Isoleucine or valine' 0 C--O 1.239 0.54 0 CA-C-O 121.39 0.614 . . . . 0.0 110.865 178.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' TYR . . . . . 0.544 ' HA ' ' HE3' ' A' ' 112' ' ' MET . 30.4 t80 -60.68 -51.89 67.44 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.312 -179.88 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.524 ' HG3' ' O ' ' A' ' 107' ' ' ARG . 0.0 OUTLIER -61.81 -28.83 69.75 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 120.485 0.183 . . . . 0.0 110.509 -175.189 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.478 HD13 ' O ' ' A' ' 107' ' ' ARG . 10.1 mp -60.56 -68.1 0.33 Allowed 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.316 175.179 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 112' ' ' MET . . . . . 0.544 ' HE3' ' HA ' ' A' ' 109' ' ' TYR . 0.0 OUTLIER -68.97 -12.46 61.69 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.475 -175.171 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 113' ' ' GLU . . . . . 0.558 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 44.5 tt0 -64.43 -63.8 1.04 Allowed 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 172.637 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 29.8 pt20 -68.62 -20.69 64.5 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.463 -175.905 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -95.3 -63.09 1.2 Allowed 'General case' 0 C--O 1.233 0.214 0 CA-C-O 120.748 0.308 . . . . 0.0 111.588 -179.289 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 23.8 m -86.22 -37.23 18.87 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 112.709 0.633 . . . . 0.0 112.709 -170.642 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' TYR . . . . . 0.558 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 31.3 t80 -64.25 -37.44 87.5 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 120.866 -0.333 . . . . 0.0 110.751 -176.036 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 24.5 p -59.45 -46.38 88.92 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 121.533 0.682 . . . . 0.0 109.74 175.15 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 22.4 mmt180 -60.81 -38.49 85.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.48 176.92 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -61.04 -41.12 95.98 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.444 178.695 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 87.6 mt -69.36 -22.63 63.72 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.309 -178.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' LYS . . . . . 0.72 ' HE3' ' HA ' ' A' ' 122' ' ' LYS . 0.0 OUTLIER -115.38 15.02 16.86 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.598 0.237 . . . . 0.0 111.602 178.61 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 96.2 p -74.7 145.86 42.76 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 120.939 0.4 . . . . 0.0 111.117 -179.217 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -56.08 -36.59 68.27 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.802 176.735 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.527 ' O ' ' HG ' ' A' ' 129' ' ' LEU . 8.2 tp -66.87 -40.68 86.33 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.553 -179.561 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 84.6 t80 -63.41 -42.88 98.77 Favored 'General case' 0 C--O 1.232 0.175 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 176.837 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 93.3 mt -64.32 -29.4 70.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.222 176.601 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -71.14 -29.67 65.52 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.934 177.159 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.527 ' HG ' ' O ' ' A' ' 125' ' ' ILE . 69.6 mt -75.19 -25.41 58.22 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.136 176.197 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 130' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -70.23 -67.36 0.5 Allowed 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.417 -179.08 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -96.26 -10.58 27.6 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.814 0.34 . . . . 0.0 111.508 -175.134 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . -78.02 61.06 3.8 Favored Glycine 0 C--N 1.33 0.211 0 N-CA-C 110.555 -1.018 . . . . 0.0 110.555 175.33 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 48.0 ttt85 -53.09 111.02 2.31 Favored Pre-proline 0 C--N 1.325 -0.468 0 C-N-CA 123.514 0.726 . . . . 0.0 111.316 -174.351 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo . . . . . 0 C--N 1.35 0.625 0 C-N-CA 122.809 2.339 . . . . 0.0 112.478 -176.807 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 68.4 p . . . . . 0 N--CA 1.479 1.012 0 N-CA-C 110.384 -0.228 . . . . 0.0 110.384 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 65.6 mtt 66.16 -175.33 0.19 Allowed 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.62 178.477 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.454 ' CG2' ' HB3' ' A' ' 7' ' ' GLU . 9.1 p -153.09 149.64 13.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.782 0.325 . . . . 0.0 111.326 -174.721 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 35.4 t -88.15 148.13 42.15 Favored Pre-proline 0 CA--C 1.534 0.344 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.809 177.359 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_exo -45.41 -33.76 9.57 Favored 'Trans proline' 0 C--N 1.357 0.984 0 C-N-CA 123.003 2.468 . . . . 0.0 112.772 178.499 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.441 ' O ' HG22 ' A' ' 9' ' ' VAL . 12.6 mm-40 -53.91 -65.01 0.64 Allowed 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.193 0.52 . . . . 0.0 110.734 177.058 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.454 ' HB3' ' CG2' ' A' ' 3' ' ' VAL . 8.1 tp10 -64.57 -33.21 75.39 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.095 -178.372 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.23 -48.24 82.34 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.496 -179.025 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.553 HG23 ' HD2' ' A' ' 10' ' ' LYS . 31.8 m -69.25 -28.52 39.03 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 C-N-CA 120.914 -0.314 . . . . 0.0 110.571 179.781 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.553 ' HD2' HG23 ' A' ' 9' ' ' VAL . 3.1 mptp? -68.59 -29.57 68.13 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.644 0.259 . . . . 0.0 110.689 175.649 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 50.7 m0 -63.89 -32.41 73.92 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 170.888 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -79.92 0.95 81.29 Favored Glycine 0 C--N 1.331 0.304 0 CA-C-N 115.362 -0.836 . . . . 0.0 113.099 -177.602 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.547 ' HG2' ' HA ' ' A' ' 10' ' ' LYS . 11.2 pt-20 -130.65 0.86 4.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.857 0.36 . . . . 0.0 110.418 177.236 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.1 m -152.46 99.02 2.44 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.494 -179.004 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.405 ' HE2' ' HB2' ' A' ' 117' ' ' TYR . 36.8 t80 -59.48 -36.01 75.2 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.141 0.496 . . . . 0.0 109.765 178.034 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -57.21 -38.31 73.52 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.277 176.734 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.638 ' NZ ' ' HB2' ' A' ' 17' ' ' LYS . 1.0 OUTLIER -75.69 -30.09 59.22 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.245 -0.888 . . . . 0.0 110.184 -173.37 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 65.8 tp -59.85 -47.2 86.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.68 173.334 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 7.5 mp -77.14 -25.37 51.95 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.987 178.782 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 42.8 t -62.45 -29.63 70.66 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.388 178.976 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -95.13 129.8 42.1 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.106 176.142 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.641 HH11 ' HB2' ' A' ' 26' ' ' GLU . 2.1 tmt_? -58.27 -33.46 69.44 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 176.557 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -61.85 -52.71 63.03 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.986 177.225 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -63.36 -37.8 95.41 Favored Glycine 0 C--N 1.334 0.419 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.89 -179.298 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 16.1 tp -54.16 -58.09 8.67 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.096 0.474 . . . . 0.0 110.481 175.626 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.641 ' HB2' HH11 ' A' ' 22' ' ' ARG . 15.6 tp10 -65.65 -40.8 92.86 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.534 -176.272 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.43 ' O ' ' HG3' ' A' ' 30' ' ' ARG . . . -61.14 -45.77 93.28 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-O 121.008 0.433 . . . . 0.0 110.71 179.072 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -70.92 -41.11 71.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.899 -177.49 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.531 HG22 ' HA ' ' A' ' 26' ' ' GLU . 14.9 t -69.93 -42.74 72.87 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 120.816 -0.354 . . . . 0.0 110.701 -177.917 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.472 ' NH1' HD11 ' A' ' 125' ' ' ILE . 0.0 OUTLIER -63.58 -27.32 69.17 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.037 0.446 . . . . 0.0 109.811 179.245 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.591 ' O ' HG22 ' A' ' 34' ' ' THR . 93.8 t80 -77.12 -44.3 30.92 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.701 -0.682 . . . . 0.0 109.802 174.068 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.417 HD23 ' HA ' ' A' ' 38' ' ' GLU . 22.9 tp -69.82 -16.63 63.31 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.789 -176.426 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.563 ' HG2' ' HG2' ' A' ' 38' ' ' GLU . 98.2 mttt -81.94 -18.21 44.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.492 179.294 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.591 HG22 ' O ' ' A' ' 31' ' ' PHE . 2.5 t -72.03 -28.48 63.39 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 121.286 0.565 . . . . 0.0 109.613 178.923 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -102.15 -1.64 31.01 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.283 176.72 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 94.5 m-85 52.63 67.66 0.95 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.373 -179.656 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 29.5 t -132.42 12.17 4.54 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.926 177.641 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.563 ' HG2' ' HG2' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -63.78 -18.0 63.64 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.969 179.364 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.424 ' HG3' ' N ' ' A' ' 40' ' ' ASN . 7.5 pt-20 -43.56 -42.5 5.08 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.027 171.775 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.485 ' HB3' HG13 ' A' ' 108' ' ' VAL . 57.1 m-80 -64.02 -46.45 84.42 Favored 'General case' 0 C--O 1.243 0.713 0 CA-C-N 115.329 -0.851 . . . . 0.0 111.404 -175.895 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.449 ' O ' HG13 ' A' ' 45' ' ' ILE . 32.4 mt -60.77 -51.75 69.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.171 179.831 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -64.57 -24.32 67.56 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.293 178.155 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.482 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 84.2 t80 -58.32 -60.98 2.92 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.711 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 6.7 p-90 -75.88 -17.73 59.68 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 119.762 -0.775 . . . . 0.0 111.854 -178.537 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.449 HG13 ' O ' ' A' ' 41' ' ' ILE . 33.6 mt -60.76 -47.04 94.9 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 170.578 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.41 -34.75 79.04 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.634 178.72 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.772 ' SG ' ' HB2' ' A' ' 101' ' ' PHE . 49.8 t -60.95 -41.68 96.78 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.507 178.831 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -71.53 -31.09 66.66 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 121.131 0.491 . . . . 0.0 109.997 179.136 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.773 ' HA ' ' HE2' ' A' ' 52' ' ' LYS . 77.8 m-20 -66.08 -32.12 73.4 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 121.308 0.575 . . . . 0.0 109.748 174.702 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 43.3 t80 -70.0 -35.53 74.44 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.455 176.212 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 6.1 tmtm? -58.9 -35.66 73.41 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.697 175.909 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.773 ' HE2' ' HA ' ' A' ' 49' ' ' ASP . 1.9 mppt? -58.25 -47.7 82.73 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.022 175.481 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.401 ' HB2' ' CG ' ' A' ' 58' ' ' GLN . 6.2 p -74.52 79.66 1.95 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.199 0.523 . . . . 0.0 110.627 -178.451 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.63 11.32 9.11 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 115.438 -0.801 . . . . 0.0 112.525 -176.299 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' GLY . . . . . 0.541 ' O ' HG12 ' A' ' 59' ' ' ILE . . . -69.3 126.61 19.77 Favored Glycine 0 CA--C 1.52 0.383 0 C-N-CA 120.81 -0.709 . . . . 0.0 111.521 177.344 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -52.84 -47.75 25.73 Favored 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 122.734 2.29 . . . . 0.0 113.081 -174.169 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 69.4 mt-30 -75.22 -40.85 58.76 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 178.735 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.557 ' O ' ' HB2' ' A' ' 62' ' ' LYS . 6.7 tp-100 -51.17 -39.19 55.82 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 114.858 -1.065 . . . . 0.0 110.704 178.933 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.541 HG12 ' O ' ' A' ' 55' ' ' GLY . 29.6 mm -50.59 -48.41 26.85 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.596 179.527 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 46.2 m-70 -68.07 -54.23 19.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.994 -173.026 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 3.7 pp -69.42 -25.81 64.31 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.084 -176.704 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.557 ' HB2' ' O ' ' A' ' 58' ' ' GLN . 2.0 tmtm? -70.21 -45.73 66.0 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 175.473 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.51 -32.66 71.67 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.545 177.11 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' LYS . . . . . 0.421 ' O ' ' HB3' ' A' ' 67' ' ' TYR . 16.2 tppt? -58.94 -46.93 86.81 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.952 0.406 . . . . 0.0 110.267 174.921 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.23 -43.77 98.34 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.599 179.067 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 64.0 mt -68.76 -29.46 43.71 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.312 178.072 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.589 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 92.0 t80 -61.65 -63.83 1.14 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.325 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -61.22 -37.07 81.7 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.711 -175.749 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -83.46 -37.91 22.54 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -173.887 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -120.67 -50.14 2.21 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -171.506 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.589 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 49.2 mm -71.67 -31.08 40.68 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 CA-C-O 120.49 0.185 . . . . 0.0 111.36 -169.176 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 12.2 mm-40 -58.15 145.64 36.27 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.168 0.509 . . . . 0.0 111.233 178.513 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 27.7 m -77.47 -45.95 24.05 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 169.756 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -85.49 60.79 6.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.569 172.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.581 ' HB3' ' HA ' ' A' ' 78' ' ' GLU . . . -97.76 161.18 26.6 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.315 -178.685 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_exo -49.6 -53.25 7.35 Favored 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 122.798 2.332 . . . . 0.0 112.745 179.216 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.524 ' HD3' ' O ' ' A' ' 77' ' ' LYS . 1.4 tmtp? -108.99 -23.25 11.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.01 -179.126 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.581 ' HA ' ' HB3' ' A' ' 75' ' ' ALA . 36.4 mt-10 70.4 156.38 0.15 Allowed 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.435 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.44 HG12 ' H ' ' A' ' 81' ' ' LEU . 50.7 t -130.5 133.09 64.18 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.643 176.944 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 35.9 m-80 -79.48 20.49 0.55 Allowed 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 122.617 0.367 . . . . 0.0 111.869 -176.326 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.44 ' H ' HG12 ' A' ' 79' ' ' VAL . 14.1 tp -62.93 147.42 50.44 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.899 176.814 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -46.57 126.34 8.17 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.852 178.641 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.547 ' HA ' ' HD3' ' A' ' 86' ' ' LYS . 87.1 t80 -57.02 -39.58 75.04 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.181 -178.368 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 83.2 t60 -66.01 -29.74 70.16 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.714 0.292 . . . . 0.0 110.834 -178.266 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 56.8 m -71.43 -46.66 59.52 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 175.454 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.565 ' O ' HG23 ' A' ' 90' ' ' THR . 26.1 mtpp -55.99 -41.49 74.92 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.584 175.223 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -52.9 -59.72 4.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 114.887 -1.051 . . . . 0.0 111.107 -179.928 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 61.3 t -56.49 -40.71 69.57 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.908 -178.104 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 75.2 mt -66.92 -47.7 81.73 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.19 -178.113 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.565 HG23 ' O ' ' A' ' 86' ' ' LYS . 82.8 p -59.8 -31.27 69.55 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 120.922 0.392 . . . . 0.0 111.117 -176.694 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -85.13 -24.5 27.98 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.99 -179.784 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 32.3 t -97.0 2.14 51.11 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.802 -179.647 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.5 tp -53.3 -29.98 16.79 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.819 -177.156 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 8.8 t -61.85 -38.39 88.06 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.955 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -141.91 81.0 15.0 Favored Pre-proline 0 N--CA 1.464 0.259 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.502 -179.652 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.45 ' HG2' HG22 ' A' ' 59' ' ' ILE . 93.2 Cg_endo -86.62 143.33 7.26 Favored 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 122.662 2.241 . . . . 0.0 111.706 176.566 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.448 ' H ' ' HB3' ' A' ' 100' ' ' SER . 36.7 p -79.39 171.55 15.01 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.135 177.559 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 36.2 tp -57.54 -30.63 65.36 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.61 -174.729 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' HIS . . . . . 0.435 ' O ' ' HB2' ' A' ' 102' ' ' ASP . 0.1 OUTLIER -132.63 43.55 2.97 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 177.939 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 100' ' ' SER . . . . . 0.448 ' HB3' ' H ' ' A' ' 97' ' ' THR . 6.3 p -53.12 -33.47 52.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.428 -0.806 . . . . 0.0 112.076 -178.723 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.772 ' HB2' ' SG ' ' A' ' 47' ' ' CYS . 38.7 m-85 -83.2 9.38 10.74 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.223 -176.807 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 102' ' ' ASP . . . . . 0.435 ' HB2' ' O ' ' A' ' 99' ' ' HIS . 19.0 t70 -56.94 -44.75 82.84 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 121.009 0.433 . . . . 0.0 110.966 -176.371 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.01 -31.98 71.58 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.57 178.078 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.425 ' HB3' ' O ' ' A' ' 101' ' ' PHE . . . -66.46 -37.03 84.23 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.498 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.402 ' OE1' ' HA ' ' A' ' 102' ' ' ASP . 1.4 mp0 -54.57 -41.68 70.13 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 120.826 0.346 . . . . 0.0 110.288 176.209 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 49.0 m -62.24 -53.37 56.13 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.592 -179.269 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 39.5 mmt-85 -57.49 -48.97 77.8 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.239 -179.679 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.485 HG13 ' HB3' ' A' ' 40' ' ' ASN . 71.2 t -64.29 -52.52 54.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.863 -176.027 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -56.11 -53.74 53.37 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.462 -176.82 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.1 -31.02 71.21 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.834 -175.043 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 54.4 tp -65.24 -47.97 74.92 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.506 -179.224 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 62.8 mtm -62.33 -39.35 92.78 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.176 0.512 . . . . 0.0 110.146 178.133 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' GLU . . . . . 0.612 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 38.4 tt0 -58.93 -62.5 1.83 Allowed 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.302 -175.848 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -54.4 -31.56 55.24 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 -169.338 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -105.28 -63.21 1.26 Allowed 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 112.085 0.402 . . . . 0.0 112.085 -175.939 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 22.5 t -70.52 -42.3 71.44 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.686 0.279 . . . . 0.0 111.101 -173.52 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' TYR . . . . . 0.612 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 28.3 t80 -67.48 -35.77 79.82 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.725 -0.216 . . . . 0.0 111.321 -175.495 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 29.8 p -65.45 -49.54 68.77 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-O 120.856 0.36 . . . . 0.0 110.366 178.538 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 38.4 ttt180 -62.54 -34.33 76.71 Favored 'General case' 0 C--O 1.225 -0.201 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 176.127 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 83.5 t80 -61.35 -33.85 74.32 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.198 177.223 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 81.5 mt -68.96 -24.74 64.29 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.767 0.317 . . . . 0.0 110.737 177.117 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 17.7 tptt -113.39 15.08 19.24 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 120.963 -0.295 . . . . 0.0 111.576 177.53 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 92.5 p -73.14 157.92 36.29 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.637 0.256 . . . . 0.0 110.53 -179.506 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -55.17 -28.32 52.02 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.041 0.448 . . . . 0.0 110.067 175.362 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.472 HD11 ' NH1' ' A' ' 30' ' ' ARG . 58.9 mt -62.43 -56.75 15.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.452 177.148 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 126' ' ' TYR . . . . . 0.51 ' OH ' ' HA ' ' A' ' 9' ' ' VAL . 32.0 t80 -70.21 -39.37 75.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.555 -175.004 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 98.5 mt -60.72 -32.28 71.55 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 121.099 0.476 . . . . 0.0 110.062 177.022 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -66.82 -36.84 83.29 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.231 177.053 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 72.4 mt -74.25 -29.26 61.6 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.753 177.984 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 130' ' ' MET . . . . . . . . . . . . . 21.3 mmt -85.93 10.81 12.93 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.425 -177.853 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -55.52 98.0 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.297 0.57 . . . . 0.0 111.72 -177.017 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 83.79 -61.72 4.7 Favored Glycine 0 N--CA 1.45 -0.383 0 CA-C-N 115.493 -0.776 . . . . 0.0 113.458 171.698 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 133' ' ' ARG . . . . . 0.524 ' HD2' ' N ' ' A' ' 133' ' ' ARG . 3.2 mpt_? -95.51 126.57 45.16 Favored Pre-proline 0 C--N 1.327 -0.407 0 O-C-N 122.851 -0.205 . . . . 0.0 111.462 -171.43 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo . . . . . 0 C--N 1.35 0.617 0 C-N-CA 123.486 2.791 . . . . 0.0 111.489 175.18 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 33.8 m . . . . . 0 N--CA 1.476 0.858 0 CA-C-O 120.789 0.328 . . . . 0.0 110.373 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 23.8 mmt -136.45 97.18 3.51 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.756 176.875 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 2.6 p -66.09 137.87 24.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.151 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.6 m -119.75 162.37 33.2 Favored Pre-proline 0 CA--C 1.534 0.333 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.39 178.335 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo -41.83 -48.53 5.92 Favored 'Trans proline' 0 C--N 1.356 0.921 0 C-N-CA 123.16 2.574 . . . . 0.0 113.339 -179.802 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.639 ' O ' ' HG2' ' A' ' 10' ' ' LYS . 49.9 mt-10 -62.81 -40.81 98.51 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 120.749 0.309 . . . . 0.0 110.978 179.765 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 15.4 tp10 -63.47 -36.41 83.65 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.185 0.517 . . . . 0.0 109.729 177.765 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.08 -41.0 91.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.263 -179.37 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.578 HG22 ' O ' ' A' ' 6' ' ' GLU . 16.3 m -69.97 -25.11 27.27 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.239 0 C-N-CA 120.797 -0.361 . . . . 0.0 110.42 179.918 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.639 ' HG2' ' O ' ' A' ' 6' ' ' GLU . 74.6 mmtt -64.12 -32.22 73.7 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 121.377 0.608 . . . . 0.0 109.667 175.199 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 31.4 m0 -79.36 -33.49 42.89 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.437 176.594 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -72.38 -0.49 46.71 Favored Glycine 0 C--N 1.334 0.441 0 CA-C-N 115.308 -0.86 . . . . 0.0 112.975 -179.577 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -115.51 -4.66 12.26 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.848 0.324 . . . . 0.0 110.889 176.506 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 43.7 t -165.32 111.05 0.92 Allowed 'General case' 0 C--O 1.234 0.264 0 CA-C-O 120.862 0.363 . . . . 0.0 111.247 -177.707 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 41.4 t80 -63.15 -32.95 74.46 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 174.381 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -58.75 -39.44 80.95 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.034 -0.984 . . . . 0.0 110.588 174.656 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.47 ' HD2' ' O ' ' A' ' 10' ' ' LYS . 38.8 ttmt -76.27 -33.86 59.12 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.402 -179.878 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 53.4 tp -55.76 -46.62 77.84 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 121.203 0.525 . . . . 0.0 110.197 176.16 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.451 HD23 ' CZ2' ' A' ' 44' ' ' TRP . 4.4 mp -76.05 -23.77 55.11 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.851 179.748 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.0 t -70.97 -25.73 62.84 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.927 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -97.8 123.53 41.8 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 69.4 mtp180 -52.66 -39.47 61.87 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 120.738 0.304 . . . . 0.0 110.859 -179.147 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -54.84 -47.25 74.38 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.683 -0.69 . . . . 0.0 109.996 177.613 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -71.21 -40.23 61.49 Favored Glycine 0 N--CA 1.45 -0.367 0 CA-C-N 115.385 -0.825 . . . . 0.0 112.0 -179.119 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.425 ' O ' HG22 ' A' ' 29' ' ' THR . 10.0 tt -58.66 -47.99 82.58 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 178.635 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -57.42 -57.14 13.95 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.333 178.331 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -58.38 -40.81 83.34 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.361 -177.346 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 93.2 t80 -74.31 -40.99 61.87 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.722 -175.572 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.626 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 11.7 t -72.54 -41.12 66.15 Favored 'General case' 0 CA--C 1.515 -0.39 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 -175.893 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 11.0 ttm180 -56.18 -42.16 76.64 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.167 173.433 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.509 ' O ' HG22 ' A' ' 34' ' ' THR . 89.1 t80 -67.46 -28.98 68.32 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.993 179.063 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 32.4 tp -86.58 -27.61 23.8 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 121.062 0.458 . . . . 0.0 110.869 -178.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.626 ' HG3' ' O ' ' A' ' 29' ' ' THR . 68.3 mttm -72.57 -17.93 61.66 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.874 179.807 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.509 HG22 ' O ' ' A' ' 31' ' ' PHE . 4.3 t -62.15 -27.25 68.81 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 120.915 0.388 . . . . 0.0 110.471 179.351 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -111.55 5.83 19.7 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.759 179.655 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 63.05 24.49 14.53 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 115.782 -0.645 . . . . 0.0 112.36 176.729 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 28.5 m -97.19 19.23 13.36 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.298 0.57 . . . . 0.0 110.279 177.246 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.537 ' HB3' ' HG2' ' A' ' 33' ' ' LYS . 11.8 pt-20 -62.14 -24.96 67.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.24 -0.891 . . . . 0.0 112.332 -173.604 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.447 ' O ' ' HB2' ' A' ' 43' ' ' PHE . 11.3 mp0 -51.61 -22.3 3.22 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -176.959 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.576 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 47.4 m-80 -71.65 -60.84 2.02 Favored 'General case' 0 C--O 1.242 0.676 0 CA-C-O 121.115 0.483 . . . . 0.0 110.901 -179.738 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.457 ' O ' HG13 ' A' ' 45' ' ' ILE . 8.4 tt -62.69 -41.02 90.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 179.37 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.457 ' OE1' ' HB2' ' A' ' 38' ' ' GLU . 0.9 OUTLIER -64.74 -27.0 68.61 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.068 176.227 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.576 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 77.6 t80 -58.85 -59.03 6.1 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 120.703 0.287 . . . . 0.0 110.536 178.061 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.451 ' CZ2' HD23 ' A' ' 19' ' ' LEU . 28.5 p-90 -74.34 -14.79 60.93 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 119.377 -0.929 . . . . 0.0 111.665 -177.162 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.457 HG13 ' O ' ' A' ' 41' ' ' ILE . 68.2 mt -71.16 -37.3 66.03 Favored 'Isoleucine or valine' 0 C--O 1.238 0.461 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 169.231 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.59 -27.04 68.68 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.961 175.473 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.442 ' SG ' ' HB2' ' A' ' 101' ' ' PHE . 53.1 t -62.44 -29.05 70.23 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.038 175.258 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.509 ' O ' ' HG2' ' A' ' 51' ' ' LYS . 19.1 mt-10 -72.31 -41.0 67.07 Favored 'General case' 0 N--CA 1.458 -0.058 0 N-CA-C 109.784 -0.451 . . . . 0.0 109.784 174.397 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -61.36 -26.38 67.79 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.025 0.44 . . . . 0.0 110.377 174.075 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -73.95 -46.14 45.89 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.984 177.4 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.509 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 64.3 pttt -70.2 -23.1 62.89 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 116.759 -0.2 . . . . 0.0 111.422 -175.459 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.478 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 19.3 ptmt -90.37 7.96 35.95 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -177.367 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 65.9 m -54.54 119.16 4.86 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 120.807 0.337 . . . . 0.0 110.443 178.904 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.14 -19.45 65.6 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.782 -175.673 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -125.4 148.47 16.88 Favored Glycine 0 C--N 1.331 0.304 0 C-N-CA 120.95 -0.643 . . . . 0.0 112.402 -177.231 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -67.93 -32.55 28.55 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.683 2.255 . . . . 0.0 111.987 -179.082 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -71.66 -34.48 69.77 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 177.734 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 56.6 tp60 -58.7 -32.45 69.18 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.123 178.745 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.498 HG22 ' HG2' ' A' ' 96' ' ' PRO . 33.9 mm -55.23 -45.44 77.54 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.496 175.668 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 57.3 m80 -66.19 -40.92 90.76 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.115 -178.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 77.6 mt -63.91 -49.99 70.49 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.02 -178.599 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.561 ' HA ' ' HE2' ' A' ' 62' ' ' LYS . 9.0 mmpt? -65.55 -42.98 91.26 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.833 -178.701 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.58 -46.78 86.21 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.804 179.648 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 6.7 tmtt? -63.39 -37.04 85.72 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.238 179.315 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.16 -51.91 65.93 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.561 179.054 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 72.6 mt -62.38 -36.01 72.51 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.193 178.46 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.587 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 74.3 t80 -58.48 -63.89 1.12 Allowed 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.489 178.849 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -54.72 -40.12 68.91 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.984 -174.608 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 56.3 tttm -96.41 -16.64 21.11 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 112.478 0.547 . . . . 0.0 112.478 -168.085 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -135.02 -53.37 0.8 Allowed 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 112.705 0.632 . . . . 0.0 112.705 -174.522 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.587 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 48.5 mm -67.41 -41.69 86.48 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 CA-C-O 120.618 0.247 . . . . 0.0 111.401 -170.047 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 51.2 tp60 -50.69 131.46 25.66 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.509 -178.358 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 20.4 m -54.82 -31.49 59.25 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.808 -174.72 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -114.9 32.52 5.97 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.049 0.452 . . . . 0.0 110.749 -178.951 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.546 ' HB3' ' HA ' ' A' ' 78' ' ' GLU . . . -60.44 158.61 28.53 Favored Pre-proline 0 CA--C 1.537 0.481 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.056 179.108 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.486 ' HD2' ' HB1' ' A' ' 75' ' ' ALA . 2.0 Cg_endo -44.05 -54.31 3.96 Favored 'Trans proline' 0 C--N 1.358 1.031 0 C-N-CA 123.672 2.915 . . . . 0.0 113.458 -175.579 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.411 ' O ' ' HG2' ' A' ' 78' ' ' GLU . 43.2 mtpt -107.16 -19.28 13.65 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 110.313 -0.254 . . . . 0.0 110.313 175.16 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.546 ' HA ' ' HB3' ' A' ' 75' ' ' ALA . 10.0 pt-20 52.89 162.84 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.969 1.308 . . . . 0.0 113.282 -179.855 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 64.5 t -126.87 137.57 57.46 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 CA-C-N 114.856 -1.066 . . . . 0.0 108.835 174.572 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.413 ' HB2' HD21 ' A' ' 111' ' ' LEU . 17.6 m120 -74.63 20.56 0.12 Allowed 'General case' 0 N--CA 1.469 0.513 0 O-C-N 123.272 0.358 . . . . 0.0 111.851 -176.34 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.433 ' O ' ' HE3' ' A' ' 86' ' ' LYS . 61.9 tp -50.07 134.42 21.93 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.487 175.034 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -47.43 140.59 5.6 Favored 'General case' 0 N--CA 1.469 0.475 0 O-C-N 123.475 0.484 . . . . 0.0 111.974 -177.744 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 99.1 m-85 -58.25 -48.27 80.97 Favored 'General case' 0 C--N 1.333 -0.109 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.705 -177.375 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.406 ' O ' ' HB3' ' A' ' 87' ' ' GLU . 83.1 t60 -59.89 -37.31 79.02 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.048 -179.478 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 25.8 m -67.88 -49.94 59.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.872 -178.547 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.55 ' O ' HG23 ' A' ' 90' ' ' THR . 17.9 ptpt -72.55 -21.33 61.18 Favored 'General case' 0 C--O 1.227 -0.112 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.451 179.278 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.406 ' HB3' ' O ' ' A' ' 84' ' ' HIS . 14.4 tp10 -57.89 -55.23 37.52 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 173.641 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 59.7 t -52.84 -49.37 47.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.926 176.47 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 68.3 mt -58.27 -44.14 87.49 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.853 -177.822 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.55 HG23 ' O ' ' A' ' 86' ' ' LYS . 64.2 p -61.28 -29.21 69.72 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 120.791 0.329 . . . . 0.0 110.824 -177.618 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 56.5 m-80 -88.51 -37.81 15.46 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.669 179.678 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 61.9 p -100.53 11.45 39.44 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 112.011 0.375 . . . . 0.0 112.011 -174.972 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.3 tp -58.37 -24.58 25.17 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 CA-C-O 120.984 0.421 . . . . 0.0 111.391 -178.457 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 8.8 t -76.45 -15.78 59.83 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.588 -179.199 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 16.3 pt20 -135.41 58.69 27.18 Favored Pre-proline 0 CA--C 1.538 0.496 0 CA-C-O 120.903 0.382 . . . . 0.0 110.979 -177.851 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.498 ' HG2' HG22 ' A' ' 59' ' ' ILE . 85.3 Cg_endo -81.62 122.47 4.0 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.656 2.237 . . . . 0.0 112.401 -176.309 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 11.5 m -71.42 161.7 30.62 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.197 177.762 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -51.21 -38.74 54.09 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 122.502 0.321 . . . . 0.0 111.654 -177.611 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 28.7 m-70 -113.21 38.88 2.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.075 0.464 . . . . 0.0 110.884 178.545 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 17.2 p -62.29 -53.07 60.48 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.254 0.55 . . . . 0.0 110.476 177.031 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.442 ' HB2' ' SG ' ' A' ' 47' ' ' CYS . 94.8 m-85 -74.11 -0.98 18.27 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.358 -179.801 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 102' ' ' ASP . . . . . 0.502 ' O ' ' HB3' ' A' ' 105' ' ' GLN . 14.6 t70 -61.71 -33.25 73.69 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.13 0.49 . . . . 0.0 109.966 178.621 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.29 -41.57 96.82 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.896 174.783 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.94 -29.6 69.51 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.198 177.817 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.502 ' HB3' ' O ' ' A' ' 102' ' ' ASP . 21.7 tm0? -56.03 -52.29 64.77 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.922 177.005 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 31.5 t -62.06 -38.47 88.92 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.559 179.813 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' ARG . . . . . 0.416 ' O ' ' HG2' ' A' ' 110' ' ' GLN . 6.2 mmp_? -61.3 -54.43 44.05 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.951 179.315 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 96.8 t -64.56 -36.63 77.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 121.309 0.576 . . . . 0.0 110.369 -179.31 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -55.99 -50.57 70.46 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.737 176.477 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.416 ' HG2' ' O ' ' A' ' 107' ' ' ARG . 11.2 pt20 -73.76 -29.21 62.08 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 120.821 0.344 . . . . 0.0 110.551 -179.205 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.44 ' O ' ' HG2' ' A' ' 114' ' ' GLN . 57.0 tp -62.85 -43.52 98.58 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.494 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 58.8 mtm -75.63 -35.44 60.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.052 177.41 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' GLU . . . . . 0.439 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 3.7 tm-20 -52.31 -53.46 44.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.938 -177.811 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 114' ' ' GLN . . . . . 0.44 ' HG2' ' O ' ' A' ' 111' ' ' LEU . 4.3 pt20 -54.29 -17.04 2.52 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 112.732 0.641 . . . . 0.0 112.732 -172.831 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 42.4 m-20 -124.88 -68.16 0.87 Allowed 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.225 0.536 . . . . 0.0 110.795 178.515 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 5.0 m -59.09 -29.7 67.55 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.422 -0.808 . . . . 0.0 112.455 -171.309 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' TYR . . . . . 0.439 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 19.6 t80 -65.87 -59.07 4.22 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 120.55 0.214 . . . . 0.0 110.93 -177.956 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 1.3 p -60.97 -38.35 85.65 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.657 0.265 . . . . 0.0 110.926 179.278 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 78.9 mtp85 -58.15 -42.31 85.62 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.001 0.429 . . . . 0.0 110.01 175.194 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -64.14 -38.99 93.03 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.416 178.045 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 92.8 mt -66.76 -21.62 66.05 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.232 -179.217 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? -108.75 -0.94 19.72 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 120.662 0.268 . . . . 0.0 111.488 179.442 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 80.4 p -66.3 152.69 44.42 Favored 'General case' 0 C--O 1.237 0.407 0 O-C-N 122.256 -0.277 . . . . 0.0 110.519 179.613 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -54.47 -31.88 56.61 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 175.717 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.558 ' O ' ' HG ' ' A' ' 129' ' ' LEU . 72.9 mt -55.66 -59.06 2.96 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.174 0 CA-C-N 115.177 -0.919 . . . . 0.0 110.678 178.518 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 58.4 t80 -59.53 -43.94 93.33 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.021 -174.743 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -66.44 -31.55 72.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.794 179.763 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -71.04 -35.41 71.96 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.015 177.656 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.558 ' HG ' ' O ' ' A' ' 125' ' ' ILE . 47.8 mt -59.88 -40.46 88.77 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.915 178.358 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 130' ' ' MET . . . . . . . . . . . . . 23.5 mmt -64.62 -63.97 0.99 Allowed 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.835 175.924 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 131' ' ' GLU . . . . . 0.735 ' HG2' ' H ' ' A' ' 133' ' ' ARG . 0.0 OUTLIER -176.08 -40.21 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.182 175.14 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 56.98 30.63 60.54 Favored Glycine 0 C--N 1.333 0.384 0 C-N-CA 121.175 -0.536 . . . . 0.0 112.192 -178.139 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 133' ' ' ARG . . . . . 0.735 ' H ' ' HG2' ' A' ' 131' ' ' GLU . 77.6 ttt180 -152.95 85.62 4.29 Favored Pre-proline 0 C--O 1.234 0.286 0 CA-C-O 120.625 0.25 . . . . 0.0 110.965 -177.762 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_endo . . . . . 0 N--CA 1.457 -0.646 0 C-N-CA 122.909 2.406 . . . . 0.0 110.443 168.557 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 47.6 t . . . . . 0 N--CA 1.476 0.844 0 CA-C-O 121.103 0.478 . . . . 0.0 110.196 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 26.4 mmt -128.22 17.63 6.57 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 176.964 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.634 HG11 HD13 ' A' ' 129' ' ' LEU . 2.9 p -106.56 131.05 57.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.068 -0.969 . . . . 0.0 111.792 -173.914 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.417 ' OG ' ' HD2' ' A' ' 5' ' ' PRO . 47.1 t -100.24 156.58 35.11 Favored Pre-proline 0 C--N 1.326 -0.415 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 170.817 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.417 ' HD2' ' OG ' ' A' ' 4' ' ' SER . 72.3 Cg_exo -42.62 -37.88 5.9 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 122.519 2.146 . . . . 0.0 112.73 176.8 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.564 ' O ' HG22 ' A' ' 9' ' ' VAL . 7.0 mm-40 -67.4 -43.12 82.06 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 121.603 0.716 . . . . 0.0 110.16 176.949 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.518 ' HB3' HG23 ' A' ' 3' ' ' VAL . 14.8 tp10 -67.46 -23.31 65.49 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.379 -0.828 . . . . 0.0 109.973 178.922 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -73.9 -47.22 39.45 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.792 178.644 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.564 HG22 ' O ' ' A' ' 6' ' ' GLU . 19.3 m -63.42 -24.13 35.09 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 C-N-CA 121.091 -0.244 . . . . 0.0 110.527 179.745 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.511 ' O ' ' HD2' ' A' ' 17' ' ' LYS . 32.6 mmtp -51.99 -46.91 65.06 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 121.343 0.592 . . . . 0.0 110.224 172.175 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 33.5 m0 -64.51 -28.22 69.51 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.563 -176.163 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -74.62 -11.04 83.12 Favored Glycine 0 N--CA 1.452 -0.256 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.401 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -80.98 -24.77 37.79 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 120.831 0.348 . . . . 0.0 110.543 179.112 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 45.8 t -172.57 131.88 0.57 Allowed 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.661 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -61.52 -25.5 67.32 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.649 174.877 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -68.65 -35.71 77.62 Favored 'General case' 0 N--CA 1.461 0.114 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.007 176.129 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.511 ' HD2' ' O ' ' A' ' 10' ' ' LYS . 35.6 ttmt -70.25 -36.92 74.78 Favored 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 115.998 -0.546 . . . . 0.0 109.928 179.313 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 48.8 tp -58.43 -45.89 87.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.201 174.929 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.7 mp -74.78 -30.64 61.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.932 -177.311 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 69.7 p -78.35 -27.19 46.95 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 120.945 0.402 . . . . 0.0 110.364 178.787 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 24.0 t-80 -72.75 110.3 6.98 Favored 'General case' 0 C--O 1.221 -0.4 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 176.305 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.18 -53.49 16.67 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 121.2 0.524 . . . . 0.0 111.019 -175.238 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -68.81 -20.66 64.33 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.827 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -78.56 -53.41 4.68 Favored Glycine 0 C--N 1.332 0.329 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.795 -179.461 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.9 tt -51.71 -38.4 54.99 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 123.223 0.609 . . . . 0.0 110.682 174.908 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.634 ' O ' ' HG2' ' A' ' 30' ' ' ARG . 10.5 tp10 -62.35 -53.67 51.65 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.88 176.847 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -55.37 -44.97 76.55 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-O 121.293 0.568 . . . . 0.0 110.932 179.772 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.416 ' CE2' HD22 ' A' ' 32' ' ' LEU . 75.3 t80 -64.2 -44.14 92.89 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.872 -179.274 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.604 HG22 ' O ' ' A' ' 26' ' ' GLU . 4.0 t -67.01 -27.79 67.71 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.067 -177.941 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.634 ' HG2' ' O ' ' A' ' 26' ' ' GLU . 35.0 mmt180 -54.95 -52.89 61.6 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 173.305 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.581 ' O ' HG22 ' A' ' 34' ' ' THR . 84.3 t80 -68.21 -45.59 72.94 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.945 -179.141 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.416 HD22 ' CE2' ' A' ' 28' ' ' PHE . 21.5 tp -63.56 -29.85 71.04 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.003 0.43 . . . . 0.0 111.179 -175.344 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.433 ' HE2' ' OG1' ' A' ' 29' ' ' THR . 67.6 mttm -80.75 -9.69 59.78 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.559 179.295 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.581 HG22 ' O ' ' A' ' 31' ' ' PHE . 0.7 OUTLIER -84.13 -28.28 27.56 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 177.955 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -98.41 4.67 48.47 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.716 178.113 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 87.1 m-85 65.16 18.01 11.27 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.811 176.051 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 25.5 m -97.21 15.01 23.97 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 121.045 0.45 . . . . 0.0 110.641 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -56.08 -24.23 38.77 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.338 -179.587 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -45.62 -43.6 12.43 Favored 'General case' 0 C--O 1.225 -0.203 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.628 176.7 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.523 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 2.0 m-20 -57.67 -59.24 5.5 Favored 'General case' 0 C--O 1.245 0.837 0 CA-C-O 121.448 0.642 . . . . 0.0 112.007 -175.288 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.473 ' O ' HG13 ' A' ' 45' ' ' ILE . 13.2 tt -61.64 -42.4 94.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.043 -175.807 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.473 ' HA ' ' HB ' ' A' ' 45' ' ' ILE . 49.3 mt-10 -78.96 -10.01 59.69 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.069 -178.943 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.523 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 72.5 t80 -67.73 -59.28 3.44 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 175.311 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.442 ' HA ' ' SG ' ' A' ' 47' ' ' CYS . 32.1 p-90 -76.06 -19.01 58.97 Favored 'General case' 0 N--CA 1.463 0.215 0 C-N-CA 119.887 -0.725 . . . . 0.0 111.414 -178.861 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.473 ' HB ' ' HA ' ' A' ' 42' ' ' GLU . 54.7 mt -62.92 -39.53 85.43 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 169.901 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.24 -35.64 81.67 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.214 175.408 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.442 ' SG ' ' HA ' ' A' ' 44' ' ' TRP . 67.4 m -63.94 -33.55 75.97 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.32 177.03 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.662 ' O ' ' HG2' ' A' ' 51' ' ' LYS . 9.0 mm-40 -66.72 -52.89 39.29 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 173.4 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -53.31 -26.31 18.22 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.349 0.595 . . . . 0.0 110.325 178.265 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.404 ' HD1' ' HD3' ' A' ' 62' ' ' LYS . 41.8 t80 -74.28 -40.3 62.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.334 177.48 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.662 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 59.9 pttt -66.94 -18.13 65.24 Favored 'General case' 0 N--CA 1.471 0.591 0 O-C-N 121.993 -0.442 . . . . 0.0 110.777 -178.302 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -72.7 -27.3 61.99 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.859 177.901 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 67.1 p -59.73 124.04 18.87 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 121.092 0.472 . . . . 0.0 110.419 -177.374 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.98 -14.23 16.03 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.752 -177.892 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -83.39 119.39 4.88 Favored Glycine 0 N--CA 1.448 -0.505 0 CA-C-N 115.934 -0.576 . . . . 0.0 112.03 -179.082 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_exo -53.15 -33.54 64.68 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.86 2.373 . . . . 0.0 112.014 179.062 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 20.3 mp0 -71.67 -39.66 70.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.614 178.495 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 55.4 tp60 -61.83 -40.55 95.66 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.26 -178.341 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 44.4 mm -49.53 -51.35 15.12 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.248 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.972 -178.853 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 76.7 m80 -64.43 -55.1 23.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.692 -0.686 . . . . 0.0 111.688 -175.858 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.502 HD12 ' N ' ' A' ' 62' ' ' LYS . 4.3 pp -71.22 -30.16 66.01 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.805 -173.277 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.502 ' N ' HD12 ' A' ' 61' ' ' LEU . 57.6 tttp -74.29 -43.4 56.96 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 -179.88 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.33 -36.05 82.41 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.252 176.033 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 6.7 tmtt? -63.18 -36.76 84.71 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 115.659 -0.7 . . . . 0.0 109.971 179.026 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -66.87 -55.42 14.84 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.482 177.585 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 66.9 mt -56.31 -35.68 43.93 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-O 121.365 0.602 . . . . 0.0 110.238 178.431 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 76.2 t80 -56.08 -56.85 15.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.071 -0.968 . . . . 0.0 110.52 178.11 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.486 ' HA ' ' HB2' ' A' ' 72' ' ' GLN . 34.3 mt-10 -77.88 -18.22 56.43 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.543 -174.638 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -82.06 -36.73 27.38 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.132 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -126.47 -51.55 1.5 Allowed 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 112.135 0.421 . . . . 0.0 112.135 -174.757 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 33.7 mm -71.98 -15.51 18.11 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.373 0 CA-C-O 121.063 0.459 . . . . 0.0 111.34 -171.946 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.486 ' HB2' ' HA ' ' A' ' 68' ' ' GLU . 16.5 tm0? -58.71 132.79 54.92 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.477 179.143 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.9 m -55.05 -37.3 66.55 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 112.613 0.597 . . . . 0.0 112.613 -170.83 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -84.02 -67.35 0.8 Allowed 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 110.116 -0.327 . . . . 0.0 110.116 179.109 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.404 ' HB3' ' HA ' ' A' ' 78' ' ' GLU . . . 64.06 156.84 0.12 Allowed Pre-proline 0 CA--C 1.539 0.53 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.682 178.971 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -73.31 -7.29 20.23 Favored 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 122.438 2.092 . . . . 0.0 112.586 -178.616 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.446 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 46.6 tttm -145.28 7.92 1.18 Allowed 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.591 -177.873 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.404 ' HA ' ' HB3' ' A' ' 75' ' ' ALA . 12.3 pt-20 38.4 86.24 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.65 0.78 . . . . 0.0 112.266 -174.596 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.425 HG12 ' H ' ' A' ' 81' ' ' LEU . 54.3 t -56.28 132.91 20.47 Favored 'Isoleucine or valine' 0 C--O 1.232 0.16 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.291 -179.376 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 43.9 m-80 -76.25 14.99 0.63 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 116.232 -0.44 . . . . 0.0 112.178 -173.31 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.425 ' H ' HG12 ' A' ' 79' ' ' VAL . 57.7 tp -62.22 133.81 55.68 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 175.537 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -61.36 167.62 3.15 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-O 121.168 0.509 . . . . 0.0 111.785 -176.356 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 92.9 t80 -69.74 -43.97 71.22 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.162 -177.211 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.469 ' O ' HG23 ' A' ' 88' ' ' VAL . 80.6 t60 -58.83 -51.83 68.32 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.446 -174.887 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 43.7 m -63.7 -42.76 97.93 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.519 -176.001 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 8.0 ptpp? -67.31 -33.03 74.42 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 120.586 -0.445 . . . . 0.0 109.984 179.236 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -61.86 -45.53 93.37 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.223 0.535 . . . . 0.0 109.898 177.554 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.469 HG23 ' O ' ' A' ' 84' ' ' HIS . 88.2 t -54.86 -43.14 66.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.976 176.583 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 72.4 mt -65.44 -43.76 94.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.886 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 39.9 p -63.72 -25.05 68.02 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 111.683 0.253 . . . . 0.0 111.683 -176.525 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 60.5 m-80 -90.43 -22.94 21.18 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 120.706 0.289 . . . . 0.0 111.16 177.807 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 29.3 t -100.24 -5.48 27.51 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.714 -0.221 . . . . 0.0 111.348 -177.373 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 9.9 tp -62.68 -23.55 33.05 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 CA-C-N 116.683 -0.235 . . . . 0.0 111.608 -175.819 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 6.8 t -58.6 -49.42 77.52 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-O 120.737 0.304 . . . . 0.0 110.88 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 81.1 mt-30 -139.43 81.53 20.26 Favored Pre-proline 0 C--O 1.235 0.316 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 178.352 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -83.1 162.5 15.52 Favored 'Trans proline' 0 CA--C 1.532 0.414 0 C-N-CA 122.834 2.356 . . . . 0.0 112.939 -176.281 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 77.1 p -90.35 174.78 7.39 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.119 174.887 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 9.2 mp -63.72 -11.86 29.66 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 120.828 0.347 . . . . 0.0 111.507 -178.987 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' HIS . . . . . 0.444 ' O ' ' HB2' ' A' ' 102' ' ' ASP . 0.2 OUTLIER -143.64 37.34 1.33 Allowed 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 -178.386 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 22.9 t -57.28 -22.86 44.53 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.969 -176.959 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.41 ' O ' ' HG3' ' A' ' 105' ' ' GLN . 82.8 m-85 -88.93 15.37 8.62 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.797 0.332 . . . . 0.0 110.616 -179.841 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 102' ' ' ASP . . . . . 0.444 ' HB2' ' O ' ' A' ' 99' ' ' HIS . 20.5 t70 -54.67 -53.12 58.97 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.75 -173.768 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.449 ' O ' ' HG2' ' A' ' 107' ' ' ARG . . . -59.98 -37.51 79.84 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 120.993 0.425 . . . . 0.0 111.002 178.807 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.74 -37.73 85.33 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.012 -178.096 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.41 ' HG3' ' O ' ' A' ' 101' ' ' PHE . 33.7 mt-30 -54.86 -57.02 13.28 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-O 121.286 0.565 . . . . 0.0 109.587 177.932 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 106' ' ' SER . . . . . 0.688 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 20.0 m -55.94 -45.58 78.77 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 114.735 -1.12 . . . . 0.0 110.828 -176.86 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 107' ' ' ARG . . . . . 0.501 ' O ' ' HG ' ' A' ' 111' ' ' LEU . 39.8 mmt180 -54.08 -57.97 9.08 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.974 0.416 . . . . 0.0 111.004 -179.56 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.562 ' HA ' HD12 ' A' ' 111' ' ' LEU . 46.3 t -63.17 -33.45 60.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.566 -178.002 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 109' ' ' TYR . . . . . 0.546 ' HA ' ' HE1' ' A' ' 112' ' ' MET . 48.3 t80 -59.14 -45.33 91.22 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.762 177.655 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.688 ' HG3' ' O ' ' A' ' 106' ' ' SER . 29.7 mt-30 -61.07 -40.92 95.52 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.528 0.68 . . . . 0.0 109.684 178.063 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.562 HD12 ' HA ' ' A' ' 108' ' ' VAL . 94.4 mt -58.04 -54.12 50.5 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.538 -1.21 . . . . 0.0 112.432 -172.296 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 112' ' ' MET . . . . . 0.546 ' HE1' ' HA ' ' A' ' 109' ' ' TYR . 0.0 OUTLIER -85.59 -12.38 51.68 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 119.864 -0.734 . . . . 0.0 110.922 -177.654 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 113' ' ' GLU . . . . . 0.676 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 38.4 tt0 -63.71 -66.69 0.51 Allowed 'General case' 0 C--O 1.233 0.231 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 174.074 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -50.91 -32.32 20.32 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.676 -177.436 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' ASP . . . . . 0.565 ' O ' ' HD3' ' A' ' 119' ' ' ARG . 25.1 t70 -97.84 -76.5 0.52 Allowed 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.612 -176.68 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 23.0 t -62.8 -38.18 89.67 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -171.55 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' TYR . . . . . 0.676 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 31.0 t80 -64.98 -38.88 92.42 Favored 'General case' 0 N--CA 1.468 0.454 0 O-C-N 122.287 -0.258 . . . . 0.0 111.157 -176.471 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 27.8 p -67.73 -42.03 82.51 Favored 'General case' 0 C--O 1.24 0.568 0 CA-C-O 121.063 0.459 . . . . 0.0 110.541 179.41 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' ARG . . . . . 0.565 ' HD3' ' O ' ' A' ' 115' ' ' ASP . 10.5 mpt_? -66.54 -34.84 78.79 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.005 176.267 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 86.3 t80 -60.83 -42.27 97.43 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 175.938 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.429 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 91.3 mt -61.87 -27.82 69.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.607 177.424 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 122' ' ' LYS . . . . . 0.456 ' HD3' ' HA ' ' A' ' 122' ' ' LYS . 64.0 mmtt -110.03 18.34 20.14 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 112.379 0.511 . . . . 0.0 112.379 179.262 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 80.2 p -79.77 147.72 31.74 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 171.919 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -55.22 -29.87 58.83 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 121.066 0.46 . . . . 0.0 110.39 176.516 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.451 ' O ' ' HG ' ' A' ' 129' ' ' LEU . 2.1 mp -60.19 -57.72 10.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.482 179.4 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 72.9 t80 -65.52 -39.34 91.71 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.664 -177.486 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.401 HD13 ' HA ' ' A' ' 127' ' ' LEU . 3.8 mm? -63.77 -33.41 75.59 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.854 178.136 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 128' ' ' ASP . . . . . 0.717 ' HA ' ' HA3' ' A' ' 132' ' ' GLY . 34.9 t70 -67.83 -34.53 76.9 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.065 0.459 . . . . 0.0 110.288 176.971 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.634 HD13 HG11 ' A' ' 3' ' ' VAL . 73.3 mt -76.41 -17.53 59.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.451 178.159 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 130' ' ' MET . . . . . 0.408 ' HE1' HG13 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -91.3 -74.29 0.51 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.829 178.493 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -146.21 34.41 0.99 Allowed 'General case' 0 C--O 1.236 0.361 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.58 -175.75 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 132' ' ' GLY . . . . . 0.717 ' HA3' ' HA ' ' A' ' 128' ' ' ASP . . . -74.36 -104.7 0.09 OUTLIER Glycine 0 C--N 1.331 0.27 0 C-N-CA 120.993 -0.622 . . . . 0.0 112.296 -179.505 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 133' ' ' ARG . . . . . 0.471 ' NH2' ' HB2' ' A' ' 128' ' ' ASP . 0.1 OUTLIER -97.67 114.57 65.13 Favored Pre-proline 0 CA--C 1.532 0.28 0 O-C-N 122.761 -0.258 . . . . 0.0 110.388 -179.976 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo . . . . . 0 C--N 1.35 0.621 0 C-N-CA 122.47 2.113 . . . . 0.0 111.708 179.021 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 29.1 m . . . . . 0 N--CA 1.475 0.779 0 N-CA-C 110.835 -0.061 . . . . 0.0 110.835 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 67.9 mtm 64.64 -72.08 0.07 Allowed 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 122.926 0.49 . . . . 0.0 110.014 -173.938 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.464 HG23 ' HB3' ' A' ' 7' ' ' GLU . 4.0 p -124.38 142.58 40.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.761 175.714 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 16.8 m -104.37 150.94 38.99 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 116.245 -0.434 . . . . 0.0 109.938 -179.679 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.414 ' HA ' ' HB3' ' A' ' 8' ' ' ALA . 1.2 Cg_endo -45.95 -31.78 8.7 Favored 'Trans proline' 0 C--N 1.353 0.797 0 C-N-CA 123.325 2.684 . . . . 0.0 112.667 178.98 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.462 ' O ' ' HD3' ' A' ' 10' ' ' LYS . 9.1 tp10 -55.74 -52.52 63.63 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-O 121.343 0.592 . . . . 0.0 110.144 175.649 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.464 ' HB3' HG23 ' A' ' 3' ' ' VAL . 9.5 tp10 -69.23 -32.67 72.07 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.727 -0.669 . . . . 0.0 109.967 179.04 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.414 ' HB3' ' HA ' ' A' ' 5' ' ' PRO . . . -62.66 -46.64 87.27 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.073 -179.348 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.424 HG22 ' O ' ' A' ' 6' ' ' GLU . 32.2 m -67.83 -27.93 39.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.313 0 CA-C-O 120.824 0.345 . . . . 0.0 110.198 179.167 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.462 ' HD3' ' O ' ' A' ' 6' ' ' GLU . 13.9 mptt -69.25 -36.52 77.25 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.027 173.244 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.406 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 49.7 m0 -60.83 -36.82 80.08 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 172.05 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -70.58 2.26 16.99 Favored Glycine 0 CA--C 1.521 0.418 0 CA-C-N 114.91 -1.041 . . . . 0.0 113.711 -177.063 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.407 ' HG3' ' O ' ' A' ' 10' ' ' LYS . 2.8 pp20? -127.74 -3.09 5.96 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 117.394 0.597 . . . . 0.0 111.499 177.326 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 74.0 m -153.34 105.78 2.89 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 120.667 0.27 . . . . 0.0 111.005 177.781 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.42 ' O ' ' HB3' ' A' ' 18' ' ' LEU . 30.9 t80 -58.33 -36.77 73.9 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 121.031 0.443 . . . . 0.0 109.932 178.292 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -57.43 -45.41 84.7 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.03 176.48 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.413 ' HB2' ' HE3' ' A' ' 17' ' ' LYS . 37.5 ttmt -65.07 -36.47 84.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.975 -178.513 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.42 ' HB3' ' O ' ' A' ' 15' ' ' PHE . 36.0 tp -59.73 -51.49 69.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.671 175.305 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 21.4 tp -80.49 -24.05 39.72 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.786 -171.704 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 70.7 m -69.57 -27.02 64.77 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.072 0.463 . . . . 0.0 110.629 178.11 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -80.15 129.73 34.71 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.568 174.067 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 10.6 tpt180 -59.47 -32.99 70.76 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 174.4 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -57.57 -50.82 71.85 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.536 176.655 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -70.78 -41.3 63.62 Favored Glycine 0 N--CA 1.449 -0.46 0 CA-C-N 115.014 -0.993 . . . . 0.0 112.217 -177.595 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 9.6 tt -60.21 -47.34 86.38 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 122.783 0.433 . . . . 0.0 110.226 179.572 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.61 ' O ' ' HG2' ' A' ' 30' ' ' ARG . 9.3 tp10 -65.09 -49.35 70.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.827 -179.339 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -59.74 -42.11 92.42 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.071 -179.646 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 76.9 t80 -68.64 -48.38 64.19 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.059 -176.449 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.422 HG22 ' O ' ' A' ' 26' ' ' GLU . 14.6 t -60.53 -36.01 77.36 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 120.695 0.283 . . . . 0.0 110.544 -177.403 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.61 ' HG2' ' O ' ' A' ' 26' ' ' GLU . 21.6 mmt180 -62.53 -52.8 62.01 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.025 0.441 . . . . 0.0 110.326 178.735 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.571 ' O ' HG22 ' A' ' 34' ' ' THR . 84.5 t80 -65.31 -31.03 71.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.609 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 17.7 tp -74.03 -26.77 60.61 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.435 -179.199 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.412 ' HG3' ' O ' ' A' ' 29' ' ' THR . 67.3 mttm -76.95 -34.77 57.59 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.26 178.839 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.571 HG22 ' O ' ' A' ' 31' ' ' PHE . 7.2 t -71.17 -8.52 54.05 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.785 0.326 . . . . 0.0 111.095 -177.013 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -119.24 17.34 13.13 Favored 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 173.142 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 33.4 p90 43.41 29.94 0.28 Allowed 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.171 0.988 . . . . 0.0 112.822 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 31.5 m -95.63 8.88 42.13 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.184 176.375 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -56.8 -21.06 25.93 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.066 -179.205 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.435 ' HG3' ' N ' ' A' ' 40' ' ' ASN . 8.9 pt-20 -49.62 -37.24 27.21 Favored 'General case' 0 C--O 1.225 -0.216 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.271 177.628 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.435 ' N ' ' HG3' ' A' ' 39' ' ' GLU . 46.9 m-80 -60.77 -61.31 2.68 Favored 'General case' 0 C--O 1.24 0.605 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.803 -174.215 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 13.0 tt -64.47 -34.02 66.75 Favored 'Isoleucine or valine' 0 C--O 1.235 0.309 0 CA-C-O 121.053 0.454 . . . . 0.0 110.019 -177.802 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.454 ' O ' HG22 ' A' ' 45' ' ' ILE . 6.3 tp10 -72.74 -25.94 61.39 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.166 -179.309 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.435 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 71.9 t80 -64.63 -65.1 0.72 Allowed 'General case' 0 C--O 1.236 0.384 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.713 179.136 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 32.6 p-90 -78.08 -9.72 59.28 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 119.747 -0.781 . . . . 0.0 112.385 -173.364 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.614 ' O ' ' HG3' ' A' ' 48' ' ' GLU . 9.5 tt -75.17 -31.54 24.76 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.201 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 169.502 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.28 -29.31 69.51 Favored 'General case' 0 C--O 1.232 0.137 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 172.472 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.575 ' SG ' ' HB2' ' A' ' 101' ' ' PHE . 52.7 t -66.22 -32.73 74.33 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.349 176.309 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.614 ' HG3' ' O ' ' A' ' 45' ' ' ILE . 0.0 OUTLIER -82.91 -28.79 29.69 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 177.379 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.441 ' O ' ' HB2' ' A' ' 52' ' ' LYS . 15.6 t70 -58.41 -27.61 64.45 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.742 0.782 . . . . 0.0 109.094 167.386 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.502 ' HB3' ' O ' ' A' ' 47' ' ' CYS . 42.4 t80 -79.3 -30.11 42.75 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 114.87 -1.059 . . . . 0.0 111.211 175.416 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.606 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 10.0 ptmt -60.74 -22.79 64.38 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 174.792 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.441 ' HB2' ' O ' ' A' ' 49' ' ' ASP . 14.0 mptt -72.47 56.79 0.37 Allowed 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.311 168.661 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.405 ' HB2' ' HD3' ' A' ' 62' ' ' LYS . 48.1 t -141.7 94.04 2.63 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.939 0.4 . . . . 0.0 109.939 175.159 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.63 -6.88 59.56 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.836 -179.757 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -106.8 123.19 7.24 Favored Glycine 0 CA--C 1.519 0.302 0 CA-C-O 119.735 -0.48 . . . . 0.0 111.916 -179.597 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_exo -56.39 -26.56 63.28 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.721 2.28 . . . . 0.0 112.507 179.714 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 30.5 mm-40 -71.49 -45.46 62.45 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 174.458 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 75.3 mm-40 -59.23 -31.75 69.35 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.06 179.342 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.4 HG23 ' HZ ' ' A' ' 50' ' ' PHE . 37.2 mm -50.9 -54.43 10.26 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.115 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.614 176.099 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 56.2 m80 -65.86 -36.5 83.62 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.84 -177.67 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 83.4 mt -68.73 -51.77 37.8 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.458 -176.459 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.405 ' HD3' ' HB2' ' A' ' 53' ' ' SER . 52.2 mtpt -71.39 -31.45 67.3 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.413 -177.65 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.72 -42.01 87.01 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 120.968 0.413 . . . . 0.0 110.06 174.415 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 22.5 tptp -59.52 -35.2 73.72 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.097 176.431 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -65.03 -57.2 9.27 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.584 176.849 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 65.3 mt -58.64 -33.33 48.43 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 CA-C-O 121.204 0.526 . . . . 0.0 110.337 179.209 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.538 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 50.5 t80 -55.86 -61.9 2.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.449 177.426 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -71.25 -31.27 67.33 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.728 -174.732 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -82.79 -25.4 32.79 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.755 -174.491 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 85.7 m-85 -133.56 -53.74 0.88 Allowed 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -174.608 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.538 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 50.0 mm -70.72 -29.54 38.39 Favored 'Isoleucine or valine' 0 C--O 1.238 0.492 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 -170.471 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -64.63 143.29 58.03 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.018 -173.703 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.8 m -63.19 -39.56 95.0 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.06 178.263 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -101.24 92.51 5.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.538 0.685 . . . . 0.0 109.708 172.9 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.503 ' HB3' ' HA ' ' A' ' 78' ' ' GLU . . . -123.27 161.33 45.82 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.2 -176.312 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.502 ' HD2' ' HB1' ' A' ' 75' ' ' ALA . 4.1 Cg_endo -45.63 -37.37 15.49 Favored 'Trans proline' 0 C--N 1.356 0.958 0 C-N-CA 123.451 2.767 . . . . 0.0 113.02 -178.143 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.41 ' HE2' ' HB3' ' A' ' 39' ' ' GLU . 8.7 ttpp -139.93 -3.43 1.43 Allowed 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.615 -0.266 . . . . 0.0 111.081 176.6 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.503 ' HA ' ' HB3' ' A' ' 75' ' ' ALA . 54.8 mt-10 60.94 157.27 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 121.457 0.646 . . . . 0.0 111.92 -176.138 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 68.0 t -119.94 144.84 27.34 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.494 175.792 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -81.59 19.93 0.97 Allowed 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 111.981 0.363 . . . . 0.0 111.981 -176.109 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 28.0 tp -65.77 140.39 58.42 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 175.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.408 ' OD2' ' HB3' ' A' ' 84' ' ' HIS . 8.4 p-10 -64.29 156.66 28.26 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.139 0.495 . . . . 0.0 112.098 -171.749 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.422 ' HA ' ' HG2' ' A' ' 86' ' ' LYS . 96.8 m-85 -60.07 -40.43 89.47 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.059 -178.514 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.467 ' O ' HG23 ' A' ' 88' ' ' VAL . 24.0 t60 -53.61 -56.3 18.34 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.314 -179.175 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.438 ' OG1' ' HG3' ' A' ' 107' ' ' ARG . 29.2 m -72.06 -42.41 66.27 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.856 -174.588 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.422 ' HG2' ' HA ' ' A' ' 83' ' ' PHE . 0.1 OUTLIER -65.76 -31.85 73.07 Favored 'General case' 0 N--CA 1.463 0.181 0 C-N-CA 120.753 -0.379 . . . . 0.0 110.203 -178.985 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -62.54 -47.93 81.73 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.328 0.585 . . . . 0.0 109.947 177.242 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.467 HG23 ' O ' ' A' ' 84' ' ' HIS . 98.1 t -53.7 -46.3 61.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.554 178.687 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 56.9 mt -72.42 -40.9 64.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.535 -176.566 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 22.0 p -62.87 -21.67 66.14 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.788 0.327 . . . . 0.0 111.25 -178.372 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 35.4 m-80 -96.46 -38.6 9.95 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.094 176.146 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 16.8 t -83.35 0.06 47.6 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.596 -0.274 . . . . 0.0 111.468 -175.896 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 8.0 tp -57.38 -26.59 26.59 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 CA-C-O 120.866 0.365 . . . . 0.0 111.628 -178.843 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.422 HG23 ' HG2' ' A' ' 95' ' ' GLN . 9.9 t -66.45 -28.2 68.42 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 120.978 0.418 . . . . 0.0 110.984 179.313 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.422 ' HG2' HG23 ' A' ' 94' ' ' THR . 22.7 pt20 -139.21 71.45 40.01 Favored Pre-proline 0 CA--C 1.534 0.355 0 CA-C-O 121.129 0.49 . . . . 0.0 110.548 -178.736 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -87.6 131.78 2.91 Favored 'Trans proline' 0 N--CA 1.459 -0.523 0 C-N-CA 122.735 2.29 . . . . 0.0 112.477 -178.886 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.471 ' N ' ' HB2' ' A' ' 100' ' ' SER . 37.9 p -83.52 171.77 13.04 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.411 174.59 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 36.9 tp -61.02 -26.03 67.32 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 121.266 0.555 . . . . 0.0 110.526 -178.791 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' HIS . . . . . 0.568 ' HB3' ' HB2' ' A' ' 102' ' ' ASP . 23.3 m-70 -119.74 34.37 5.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.522 177.171 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 100' ' ' SER . . . . . 0.471 ' HB2' ' N ' ' A' ' 97' ' ' THR . 22.2 t -61.74 -31.81 72.01 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.32 177.337 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.575 ' HB2' ' SG ' ' A' ' 47' ' ' CYS . 88.0 m-85 -91.9 6.36 46.5 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.966 -178.77 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 102' ' ' ASP . . . . . 0.568 ' HB2' ' HB3' ' A' ' 99' ' ' HIS . 12.8 t70 -64.11 -41.65 97.17 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.117 0.484 . . . . 0.0 110.347 -177.178 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.445 ' O ' ' HG2' ' A' ' 107' ' ' ARG . . . -59.32 -43.3 92.68 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.179 176.254 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.0 -37.41 85.84 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.413 177.778 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 21.5 tm0? -57.86 -45.38 86.4 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.169 176.922 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' SER . . . . . 0.674 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 47.7 t -60.15 -58.44 8.53 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.527 -0.761 . . . . 0.0 110.165 176.962 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' ARG . . . . . 0.446 ' O ' ' HG ' ' A' ' 111' ' ' LEU . 23.2 mmm180 -49.22 -55.42 12.62 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 120.945 0.402 . . . . 0.0 111.336 -177.864 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 74.6 t -57.44 -40.03 72.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.026 179.444 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' TYR . . . . . 0.514 ' HA ' ' HE2' ' A' ' 112' ' ' MET . 55.6 t80 -64.26 -37.35 87.16 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.772 178.714 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.674 ' HG3' ' O ' ' A' ' 106' ' ' SER . 42.7 mt-30 -67.56 -42.1 83.15 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 178.24 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 107' ' ' ARG . 93.4 mt -59.71 -45.02 93.42 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.819 -1.082 . . . . 0.0 110.679 -179.171 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 112' ' ' MET . . . . . 0.514 ' HE2' ' HA ' ' A' ' 109' ' ' TYR . 54.5 mtm -62.08 -41.34 98.07 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 176.811 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 113' ' ' GLU . . . . . 0.634 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 4.5 tm-20 -61.92 -71.03 0.16 Allowed 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.913 -176.169 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -57.69 -18.13 19.01 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -171.487 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' ASP . . . . . 0.468 ' O ' ' HD3' ' A' ' 119' ' ' ARG . 7.8 m-20 -118.26 -75.99 0.58 Allowed 'General case' 0 N--CA 1.463 0.201 0 N-CA-C 111.576 0.213 . . . . 0.0 111.576 179.075 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 17.6 m -58.56 -28.37 65.46 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -171.641 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' TYR . . . . . 0.634 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 68.4 t80 -78.11 -45.32 23.71 Favored 'General case' 0 C--N 1.333 -0.123 0 N-CA-C 110.694 -0.113 . . . . 0.0 110.694 -176.825 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 118' ' ' THR . . . . . 0.55 HG23 ' HD2' ' A' ' 119' ' ' ARG . 11.5 t -66.62 -40.22 88.68 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-O 120.918 0.389 . . . . 0.0 110.151 178.294 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 119' ' ' ARG . . . . . 0.55 ' HD2' HG23 ' A' ' 118' ' ' THR . 3.1 mpt_? -61.53 -38.66 88.22 Favored 'General case' 0 N--CA 1.461 0.104 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 173.754 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.48 ' HA ' ' HB3' ' A' ' 123' ' ' SER . 76.8 t80 -64.7 -36.16 83.39 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.322 177.38 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 89.9 mt -59.76 -28.99 67.87 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.646 0.26 . . . . 0.0 110.576 178.035 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 122' ' ' LYS . . . . . 0.451 ' HD3' ' HA ' ' A' ' 122' ' ' LYS . 31.1 mmtp -115.1 16.9 16.97 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 176.121 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 123' ' ' SER . . . . . 0.48 ' HB3' ' HA ' ' A' ' 120' ' ' PHE . 83.6 p -70.42 141.48 52.12 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 173.408 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -55.88 -38.14 69.75 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.243 -178.841 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.476 ' O ' ' HG ' ' A' ' 129' ' ' LEU . 7.7 tp -65.09 -42.86 95.54 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.147 -179.318 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 73.6 t80 -69.62 -36.97 76.64 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.743 0.306 . . . . 0.0 110.684 -179.609 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 94.4 mt -66.39 -29.88 70.14 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 120.934 0.397 . . . . 0.0 110.019 177.3 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -65.53 -34.05 77.35 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.048 173.913 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.476 ' HG ' ' O ' ' A' ' 125' ' ' ILE . 55.2 mt -76.3 -29.95 57.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.592 177.325 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 130' ' ' MET . . . . . . . . . . . . . 4.7 mmt -63.82 -21.52 66.47 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 116.094 -0.503 . . . . 0.0 112.128 -179.451 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -97.15 -3.58 40.79 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.738 0.304 . . . . 0.0 110.628 178.573 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 59.58 59.58 10.32 Favored Glycine 0 C--N 1.334 0.433 0 N-CA-C 111.393 -0.683 . . . . 0.0 111.393 -176.567 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 133' ' ' ARG . . . . . 0.413 HH11 ' HD2' ' A' ' 133' ' ' ARG . 21.1 ttt180 -43.87 115.55 2.11 Favored Pre-proline 0 C--O 1.238 0.483 0 C-N-CA 123.265 0.626 . . . . 0.0 112.393 -174.876 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo . . . . . 0 C--N 1.349 0.578 0 C-N-CA 122.523 2.148 . . . . 0.0 111.257 176.371 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 28.7 t . . . . . 0 N--CA 1.478 0.953 0 N-CA-C 110.133 -0.321 . . . . 0.0 110.133 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 15.6 tpt 61.61 89.94 0.07 Allowed 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.464 0.65 . . . . 0.0 110.213 -175.992 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.451 HG11 ' CH2' ' A' ' 11' ' ' TRP . 8.6 p -78.19 160.78 4.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.494 -174.101 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.408 ' N ' HG22 ' A' ' 3' ' ' VAL . 36.9 m -66.06 132.06 94.56 Favored Pre-proline 0 CA--C 1.534 0.363 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.889 172.602 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_exo -49.14 -33.98 29.06 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 123.159 2.573 . . . . 0.0 113.433 -176.012 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.509 ' O ' ' HG2' ' A' ' 10' ' ' LYS . 42.1 mt-10 -61.76 -45.61 93.17 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-O 120.809 0.337 . . . . 0.0 110.803 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.407 ' O ' ' HB2' ' A' ' 10' ' ' LYS . 17.4 tp10 -70.22 -33.38 71.6 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.155 0.502 . . . . 0.0 109.7 177.814 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.21 -45.5 92.98 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.804 179.124 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 30.7 m -75.02 -19.06 16.28 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-O 120.758 0.313 . . . . 0.0 110.837 179.486 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.509 ' HG2' ' O ' ' A' ' 6' ' ' GLU . 72.0 mmtt -67.06 -29.1 68.79 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.513 173.274 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.451 ' CH2' HG11 ' A' ' 3' ' ' VAL . 54.2 m0 -62.08 -24.11 66.91 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.074 -179.28 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -65.59 -12.07 55.26 Favored Glycine 0 CA--C 1.521 0.424 0 C-N-CA 121.173 -0.537 . . . . 0.0 112.593 177.325 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -74.71 -49.67 20.31 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 120.718 0.294 . . . . 0.0 110.611 177.866 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 30.5 m -154.19 128.76 9.26 Favored 'General case' 0 C--O 1.24 0.575 0 CA-C-O 121.024 0.44 . . . . 0.0 111.639 -175.127 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.454 ' CD1' HD23 ' A' ' 18' ' ' LEU . 84.8 t80 -55.55 -26.84 45.55 Favored 'General case' 0 N--CA 1.461 0.111 0 CA-C-N 115.641 -0.708 . . . . 0.0 109.931 175.141 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -51.89 -55.39 20.43 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.377 -0.828 . . . . 0.0 111.168 177.243 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.485 ' HD2' ' O ' ' A' ' 10' ' ' LYS . 17.3 ptpt -71.94 -30.42 65.3 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 120.927 -0.309 . . . . 0.0 110.363 -176.616 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.454 HD23 ' CD1' ' A' ' 15' ' ' PHE . 51.6 tp -56.32 -51.93 66.43 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.068 -0.514 . . . . 0.0 109.98 175.052 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 51.4 tp -71.19 -35.26 71.51 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.86 -178.138 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.0 m -74.3 -22.26 59.36 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.878 -177.103 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.9 t-80 -90.61 117.66 29.45 Favored 'General case' 0 N--CA 1.462 0.134 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 -179.641 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.539 ' HD3' ' H ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -36.68 -53.46 0.9 Allowed 'General case' 0 N--CA 1.475 0.817 0 O-C-N 123.847 0.717 . . . . 0.0 111.852 -176.682 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -56.93 -45.36 82.8 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.77 -177.454 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -65.95 -44.64 91.31 Favored Glycine 0 C--N 1.333 0.372 0 CA-C-N 115.727 -0.669 . . . . 0.0 111.791 -179.198 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 8.0 tt -57.9 -44.84 87.03 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.888 0.375 . . . . 0.0 110.299 177.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -64.33 -46.43 83.54 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.555 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -63.76 -35.41 80.49 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 120.999 0.428 . . . . 0.0 110.504 179.597 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -71.0 -49.51 44.45 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.419 -0.809 . . . . 0.0 110.956 -176.393 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 9.1 t -62.86 -36.12 82.24 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 120.656 0.265 . . . . 0.0 110.704 -178.552 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 74.6 mtm180 -64.92 -38.94 92.63 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 120.731 0.3 . . . . 0.0 111.104 179.661 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.583 ' O ' HG22 ' A' ' 34' ' ' THR . 87.0 t80 -76.55 -50.69 13.3 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.055 0.455 . . . . 0.0 110.553 178.789 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 36.8 tp -58.36 -24.95 61.37 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.011 -178.495 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 24.0 ttmm -63.75 -33.22 75.16 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.599 -178.665 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.583 HG22 ' O ' ' A' ' 31' ' ' PHE . 6.2 t -68.82 -20.51 64.31 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 121.183 -0.207 . . . . 0.0 111.457 -174.966 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -105.03 -1.5 25.61 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.806 0.336 . . . . 0.0 110.463 177.755 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 61.62 18.99 10.05 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 115.734 -0.666 . . . . 0.0 112.306 175.775 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.3 m -84.05 2.92 36.9 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 121.077 0.465 . . . . 0.0 109.955 176.157 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -51.65 -21.99 3.07 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.252 -0.886 . . . . 0.0 112.709 -177.46 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -58.61 -17.27 20.69 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -176.663 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.461 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 20.7 p30 -67.78 -39.44 84.08 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 121.269 0.557 . . . . 0.0 110.044 175.329 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.461 ' HA ' ' CZ2' ' A' ' 44' ' ' TRP . 58.6 mt -65.53 -47.34 86.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.68 175.406 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.538 ' HA ' HG22 ' A' ' 45' ' ' ILE . 2.8 mp0 -64.51 -24.0 67.46 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.931 176.239 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.461 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 60.3 t80 -61.58 -62.91 1.48 Allowed 'General case' 0 C--O 1.237 0.445 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.464 179.728 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.461 ' CZ2' ' HA ' ' A' ' 41' ' ' ILE . 3.6 p-90 -82.78 -7.81 59.63 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 120.292 -0.563 . . . . 0.0 112.422 -177.678 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.538 HG22 ' HA ' ' A' ' 42' ' ' GLU . 5.5 tt -76.9 -30.37 18.2 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 171.377 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.25 -35.5 71.43 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.735 173.901 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.415 ' O ' ' HB3' ' A' ' 50' ' ' PHE . 71.3 m -63.88 -33.74 76.38 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.12 174.524 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.614 ' O ' ' HG3' ' A' ' 52' ' ' LYS . 3.5 tm-20 -63.59 -51.24 66.19 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 108.434 -0.951 . . . . 0.0 108.434 173.109 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.553 ' HA ' ' CD ' ' A' ' 52' ' ' LYS . 27.5 t70 -50.36 -31.98 16.12 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.601 176.447 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.415 ' HB3' ' O ' ' A' ' 47' ' ' CYS . 78.9 t80 -70.51 -43.82 68.87 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.548 -178.578 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.575 ' HE3' ' HG2' ' A' ' 48' ' ' GLU . 18.6 pttp -69.13 -16.58 63.69 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 120.89 0.376 . . . . 0.0 110.823 -177.502 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.614 ' HG3' ' O ' ' A' ' 48' ' ' GLU . 15.8 mtpp -75.78 -14.02 60.3 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.256 178.739 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 79.4 p -58.22 -47.83 82.27 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.254 -175.669 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 46.91 18.57 0.07 Allowed 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.285 1.034 . . . . 0.0 112.769 -179.413 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' GLY . . . . . 0.469 ' O ' HG12 ' A' ' 59' ' ' ILE . . . -129.89 123.34 4.02 Favored Glycine 0 C--N 1.331 0.251 0 N-CA-C 111.313 -0.715 . . . . 0.0 111.313 -179.121 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.402 ' O ' ' HB ' ' A' ' 59' ' ' ILE . 9.8 Cg_endo -48.9 -52.16 9.18 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 123.378 2.719 . . . . 0.0 112.851 -173.758 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 27.2 pt20 -63.17 -39.46 94.71 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 120.717 0.294 . . . . 0.0 111.085 -179.214 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -68.47 -26.51 65.52 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.395 -178.317 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.469 HG12 ' O ' ' A' ' 55' ' ' GLY . 38.4 mm -55.91 -49.81 72.78 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.213 0 CA-C-O 121.07 0.462 . . . . 0.0 110.169 175.36 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 63.4 m-70 -64.92 -35.29 80.69 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.375 -177.409 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 93.8 mt -73.13 -54.32 8.79 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.518 -176.364 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 32.4 mmtp -63.74 -35.67 81.36 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.539 0.209 . . . . 0.0 110.785 -179.459 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.47 -48.82 80.1 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.189 176.499 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 17.9 tppt? -57.26 -40.42 77.66 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.611 177.266 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.53 -64.05 1.08 Allowed 'General case' 0 C--O 1.234 0.238 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.795 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 64.7 mt -56.39 -36.82 48.32 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 CA-C-O 121.14 0.495 . . . . 0.0 110.542 -179.463 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.481 ' CE1' HG22 ' A' ' 90' ' ' THR . 8.3 t80 -54.55 -73.94 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.348 -179.791 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.405 ' HG3' ' CD2' ' A' ' 67' ' ' TYR . 52.7 mt-10 -75.68 -3.55 35.28 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 -172.686 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.5 tppt? -95.18 -34.89 12.08 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 120.981 -0.288 . . . . 0.0 110.677 177.654 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 72.8 m-85 -130.93 -52.74 1.05 Allowed 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -173.723 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.464 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 46.4 mm -61.0 -44.19 97.69 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 CA-C-O 121.146 0.498 . . . . 0.0 111.388 -171.883 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -69.12 135.35 50.59 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.606 -175.032 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 22.1 m -70.11 -31.88 69.64 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.541 0.686 . . . . 0.0 109.353 176.631 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -83.74 13.26 4.9 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.151 -0.931 . . . . 0.0 110.816 176.859 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.559 ' HB1' ' HD2' ' A' ' 76' ' ' PRO . . . -63.76 160.21 47.13 Favored Pre-proline 0 CA--C 1.532 0.286 0 CA-C-N 116.394 -0.367 . . . . 0.0 110.133 176.118 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' PRO . . . . . 0.559 ' HD2' ' HB1' ' A' ' 75' ' ' ALA . 8.7 Cg_endo -50.27 -30.07 25.09 Favored 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 123.005 2.47 . . . . 0.0 113.164 -174.935 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.508 ' HD2' ' O ' ' A' ' 78' ' ' GLU . 0.1 OUTLIER -146.1 8.47 1.08 Allowed 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 120.639 0.257 . . . . 0.0 111.155 177.781 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.556 ' HA ' ' HB3' ' A' ' 75' ' ' ALA . 9.8 pt-20 45.01 -172.98 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 124.715 1.206 . . . . 0.0 114.022 -179.871 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 54.3 t -153.99 139.54 11.02 Favored 'Isoleucine or valine' 0 C--O 1.237 0.408 0 CA-C-N 114.812 -1.086 . . . . 0.0 108.173 178.203 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 -70.39 88.04 0.64 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.637 0.732 . . . . 0.0 111.082 -179.074 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 14.0 tp -133.91 145.0 49.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 114.751 -1.113 . . . . 0.0 109.175 178.906 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -54.12 142.15 26.47 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 121.299 0.571 . . . . 0.0 112.256 -176.168 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 40.8 p90 -66.5 -43.51 85.13 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.109 -0.95 . . . . 0.0 111.789 -176.909 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.421 ' O ' ' HB3' ' A' ' 87' ' ' GLU . 85.2 t60 -70.37 -30.41 67.33 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.109 0.481 . . . . 0.0 110.461 -175.854 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 47.3 m -64.82 -52.15 58.28 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.285 177.666 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.475 ' O ' HG23 ' A' ' 90' ' ' THR . 18.0 ptpt -70.64 -24.04 62.64 Favored 'General case' 0 C--O 1.226 -0.164 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.623 -178.697 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.421 ' HB3' ' O ' ' A' ' 84' ' ' HIS . 12.0 tp10 -54.17 -58.73 6.24 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-O 121.448 0.642 . . . . 0.0 110.014 173.406 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 61.4 t -56.09 -42.26 71.81 Favored 'Isoleucine or valine' 0 C--O 1.237 0.44 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.303 178.458 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.403 HG21 HG21 ' A' ' 71' ' ' ILE . 70.1 mt -60.71 -47.36 93.4 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.248 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.207 -179.231 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.481 HG22 ' CE1' ' A' ' 67' ' ' TYR . 60.3 p -59.57 -30.56 68.73 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 121.037 0.446 . . . . 0.0 110.8 -177.599 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 -87.01 -17.29 33.34 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 115.817 -0.629 . . . . 0.0 112.26 -175.949 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 43.3 p -121.66 3.6 10.11 Favored 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 -179.745 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.6 tp -61.53 -23.51 30.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 CA-C-O 120.776 0.322 . . . . 0.0 111.631 -175.79 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.416 HG23 ' HG3' ' A' ' 95' ' ' GLN . 9.7 t -67.28 -32.97 74.32 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.131 -178.964 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.416 ' HG3' HG23 ' A' ' 94' ' ' THR . 96.4 mt-30 -136.33 75.58 52.04 Favored Pre-proline 0 N--CA 1.464 0.274 0 N-CA-C 110.321 -0.251 . . . . 0.0 110.321 -178.603 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -92.76 176.45 1.62 Allowed 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 122.82 2.346 . . . . 0.0 112.713 179.13 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 75.4 p -117.31 178.28 4.43 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.426 175.519 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -57.19 -24.94 57.89 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 112.154 0.427 . . . . 0.0 112.154 -173.36 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 66.6 m80 -138.93 31.17 2.22 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 112.365 0.506 . . . . 0.0 112.365 -177.024 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 66.0 m -62.08 -21.57 65.06 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 121.078 0.465 . . . . 0.0 110.941 175.221 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -81.82 8.2 10.83 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.374 -179.676 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -60.79 -37.99 83.8 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 120.629 0.252 . . . . 0.0 110.479 -177.664 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.45 -43.23 99.22 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.661 177.499 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.34 -46.54 79.82 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.507 179.731 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.443 ' HG2' ' HB3' ' A' ' 44' ' ' TRP . 51.1 mt-30 -60.29 -41.81 94.16 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.007 177.719 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 106' ' ' SER . . . . . 0.675 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 45.7 t -55.82 -58.49 7.64 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.851 178.238 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 2.5 mmp_? -46.98 -59.05 3.37 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.584 -178.805 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.541 ' O ' ' HG3' ' A' ' 112' ' ' MET . 11.4 p -64.7 -33.35 62.7 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.552 -175.862 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 15.8 t80 -66.5 -43.54 85.02 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.2 -179.521 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.675 ' HG3' ' O ' ' A' ' 106' ' ' SER . 31.1 mt-30 -62.7 -40.3 96.72 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 121.666 0.746 . . . . 0.0 109.014 177.599 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 89.7 mt -60.63 -41.0 94.01 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.531 -1.213 . . . . 0.0 110.415 176.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' MET . . . . . 0.541 ' HG3' ' O ' ' A' ' 108' ' ' VAL . 46.2 mtm -60.87 -39.66 90.01 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 177.338 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 113' ' ' GLU . . . . . 0.593 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 43.9 tt0 -61.42 -65.97 0.61 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.918 0.39 . . . . 0.0 110.208 179.104 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 114' ' ' GLN . . . . . 0.412 ' HG2' ' O ' ' A' ' 110' ' ' GLN . 10.7 pt20 -75.07 16.0 0.36 Allowed 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -172.843 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -141.99 -65.44 0.42 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.724 0.297 . . . . 0.0 110.686 173.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 4.2 m -68.21 -38.35 81.82 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.391 -176.351 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' TYR . . . . . 0.593 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 36.1 t80 -71.51 -40.83 69.88 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 110.285 -0.265 . . . . 0.0 110.285 -175.027 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 29.4 p -63.39 -43.56 97.23 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 120.921 0.391 . . . . 0.0 110.239 177.678 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 69.0 mtp85 -60.0 -40.49 89.4 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.003 174.904 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 58.3 t80 -66.58 -34.15 77.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.204 179.243 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 95.6 mt -65.27 -26.3 68.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.949 0.404 . . . . 0.0 110.249 175.562 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 122' ' ' LYS . . . . . 0.631 ' HE2' ' HA ' ' A' ' 122' ' ' LYS . 11.4 mmpt? -88.58 -16.44 32.52 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.335 179.263 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 59.1 p -61.66 139.9 58.24 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 120.99 0.424 . . . . 0.0 111.198 -177.161 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 16.6 p-10 -62.37 -31.31 71.95 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.814 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -64.43 -45.26 96.35 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.393 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 126' ' ' TYR . . . . . 0.451 ' O ' ' HG2' ' A' ' 130' ' ' MET . 69.5 t80 -69.12 -43.18 74.95 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 120.786 0.326 . . . . 0.0 110.333 -179.488 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 99.4 mt -60.42 -35.99 77.11 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.496 178.995 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -63.72 -38.99 93.2 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.347 177.215 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 91.8 mt -70.54 -27.52 64.22 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.986 179.263 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 130' ' ' MET . . . . . 0.451 ' HG2' ' O ' ' A' ' 126' ' ' TYR . 30.1 mmt -64.65 -63.51 1.11 Allowed 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.223 179.113 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 55.54 21.84 4.72 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.047 177.579 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 65.48 17.66 64.63 Favored Glycine 0 C--N 1.336 0.566 0 CA-C-N 116.061 -0.518 . . . . 0.0 113.201 -179.776 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 27.1 mmt180 -71.7 140.75 84.27 Favored Pre-proline 0 CA--C 1.533 0.295 0 CA-C-O 120.472 0.177 . . . . 0.0 110.852 -178.644 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo . . . . . 0 C--N 1.349 0.557 0 C-N-CA 122.766 2.311 . . . . 0.0 112.262 177.74 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 22.5 m . . . . . 0 N--CA 1.475 0.817 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 71.5 mtp 66.17 -176.01 0.19 Allowed 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.566 -177.403 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.46 HG11 HD22 ' A' ' 129' ' ' LEU . 7.0 p -55.3 150.1 2.44 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 CA-C-N 115.179 -0.919 . . . . 0.0 112.749 -178.132 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.426 ' H ' ' HB3' ' A' ' 7' ' ' GLU . 32.2 t -133.66 150.28 74.38 Favored Pre-proline 0 CA--C 1.534 0.351 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 173.686 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_exo -43.38 -40.74 10.05 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.905 2.404 . . . . 0.0 113.018 179.87 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.536 ' O ' HG22 ' A' ' 9' ' ' VAL . 37.6 tt0 -66.81 -39.55 87.76 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 121.146 0.498 . . . . 0.0 110.453 178.744 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.426 ' HB3' ' H ' ' A' ' 4' ' ' SER . 18.3 tp10 -63.04 -35.84 81.57 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.232 0.539 . . . . 0.0 109.557 177.267 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.88 -45.2 93.66 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.553 -0.748 . . . . 0.0 111.346 -178.949 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.536 HG22 ' O ' ' A' ' 6' ' ' GLU . 24.6 m -67.56 -26.41 35.47 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.293 0 CA-C-O 120.765 0.317 . . . . 0.0 110.589 179.877 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.523 ' HG2' ' O ' ' A' ' 6' ' ' GLU . 74.3 mmtt -65.95 -29.5 69.92 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.263 0.554 . . . . 0.0 110.145 174.692 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 36.4 m0 -79.07 -30.07 43.75 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 174.321 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -69.64 -11.46 65.6 Favored Glycine 0 C--N 1.332 0.354 0 CA-C-N 115.286 -0.87 . . . . 0.0 112.65 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -106.83 -36.3 6.7 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 120.705 0.288 . . . . 0.0 110.778 175.547 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 46.4 t -123.85 105.5 9.69 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 120.905 0.383 . . . . 0.0 111.081 -176.184 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.409 ' O ' HD13 ' A' ' 19' ' ' LEU . 30.1 t80 -61.67 -33.64 74.34 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.995 177.391 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -61.15 -40.9 95.57 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.389 175.365 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.54 ' NZ ' ' HB2' ' A' ' 17' ' ' LYS . 4.1 ttmp? -69.75 -33.33 72.3 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.061 -178.457 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 67.6 tp -56.83 -48.52 77.84 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.029 173.864 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.409 HD13 ' O ' ' A' ' 15' ' ' PHE . 4.9 mp -76.0 -26.47 56.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.011 -179.619 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.0 t -72.92 -35.21 66.99 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.479 -178.613 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 -86.87 125.01 33.71 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.379 -0.601 . . . . 0.0 109.379 -178.88 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.442 ' O ' ' HB2' ' A' ' 26' ' ' GLU . 17.5 ttp180 -46.27 -47.27 18.2 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 122.87 0.468 . . . . 0.0 111.361 -178.283 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -58.59 -41.45 85.82 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.125 -179.172 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -67.09 -52.19 34.01 Favored Glycine 0 N--CA 1.449 -0.444 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.95 -177.434 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.1 tt -56.49 -40.94 75.81 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.091 0.472 . . . . 0.0 110.173 176.147 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.442 ' HB2' ' O ' ' A' ' 22' ' ' ARG . 1.1 tm-20 -59.04 -55.69 31.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.667 179.804 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.534 ' HA ' ' HD3' ' A' ' 30' ' ' ARG . . . -65.85 -39.29 90.61 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.8 -177.196 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -67.33 -40.94 85.96 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.919 -175.445 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 29.1 p -62.81 -45.01 94.61 Favored 'General case' 0 CA--C 1.529 0.147 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 178.238 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.534 ' HD3' ' HA ' ' A' ' 27' ' ' ALA . 53.0 mtp180 -54.23 -44.36 71.64 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.508 176.286 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.57 ' O ' HG22 ' A' ' 34' ' ' THR . 77.6 t80 -58.94 -48.2 82.34 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.756 178.542 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.412 HD23 HG22 ' A' ' 41' ' ' ILE . 14.2 tp -76.05 -10.9 59.79 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.012 -175.056 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -92.56 -9.87 39.64 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.552 177.847 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.57 HG22 ' O ' ' A' ' 31' ' ' PHE . 2.4 t -76.09 -15.57 60.07 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 121.517 0.675 . . . . 0.0 110.019 178.327 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.427 ' O ' ' N ' ' A' ' 37' ' ' SER . 7.9 pt-20 -145.9 90.58 1.99 Allowed 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 108.358 -0.978 . . . . 0.0 108.358 176.013 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 18.2 p90 -29.65 82.63 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 114.279 1.215 . . . . 0.0 114.279 -171.309 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.427 ' N ' ' O ' ' A' ' 35' ' ' GLU . 16.0 m -134.54 9.21 3.66 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 168.938 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -58.78 -32.13 69.02 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 114.1 -1.409 . . . . 0.0 111.603 -175.522 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.497 ' O ' ' HB2' ' A' ' 43' ' ' PHE . 5.1 mp0 -58.76 -20.21 47.52 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.645 -175.34 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.627 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 44.7 m-80 -75.81 -56.64 4.48 Favored 'General case' 0 C--O 1.241 0.646 0 CA-C-O 121.069 0.462 . . . . 0.0 111.092 -179.02 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.474 ' O ' HG13 ' A' ' 45' ' ' ILE . 10.0 tt -62.14 -43.84 98.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 179.511 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.606 ' HA ' ' HB ' ' A' ' 45' ' ' ILE . 52.1 mt-10 -72.75 -16.53 61.64 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.808 -179.009 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.627 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 66.5 t80 -61.27 -58.32 8.76 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 172.249 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.433 ' O ' ' HB3' ' A' ' 47' ' ' CYS . 37.1 p-90 -78.43 -15.21 58.9 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 119.404 -0.919 . . . . 0.0 111.493 -179.504 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.606 ' HB ' ' HA ' ' A' ' 42' ' ' GLU . 60.4 mt -69.03 -34.3 63.25 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.292 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 168.598 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.67 -31.84 73.13 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.965 -0.562 . . . . 0.0 109.784 173.865 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.433 ' HB3' ' O ' ' A' ' 44' ' ' TRP . 53.6 t -63.83 -33.6 76.05 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.587 173.946 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.452 ' HB3' ' O ' ' A' ' 45' ' ' ILE . 15.0 tp10 -66.16 -49.11 68.52 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 174.671 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.431 ' HA ' ' HG2' ' A' ' 52' ' ' LYS . 0.3 OUTLIER -66.66 -15.79 63.74 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.7 176.188 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.505 ' CZ ' HG23 ' A' ' 59' ' ' ILE . 92.7 t80 -78.44 -43.1 28.11 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.879 174.941 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.417 ' HD3' ' CE1' ' A' ' 99' ' ' HIS . 31.8 ttpt -61.13 -38.83 87.78 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.182 -179.359 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.431 ' HG2' ' HA ' ' A' ' 49' ' ' ASP . 21.9 ptmt -76.05 14.32 0.72 Allowed 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.665 -177.329 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.459 ' HB2' HD13 ' A' ' 59' ' ' ILE . 6.5 m -94.45 88.62 5.55 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 175.116 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.3 pptp? -74.27 -9.62 58.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.297 -177.186 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -91.19 118.52 5.43 Favored Glycine 0 N--CA 1.448 -0.505 0 N-CA-C 111.559 -0.617 . . . . 0.0 111.559 175.562 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.464 ' O ' ' HB ' ' A' ' 59' ' ' ILE . 19.3 Cg_endo -56.65 -30.33 83.24 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.847 2.365 . . . . 0.0 112.019 -176.991 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' GLN . . . . . 0.412 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 73.2 mt-30 -71.88 -45.32 61.72 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.916 -0.583 . . . . 0.0 109.858 177.805 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 50.9 tp60 -59.0 -33.13 70.36 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.848 179.256 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.505 HG23 ' CZ ' ' A' ' 50' ' ' PHE . 23.1 mm -55.24 -56.69 10.12 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.732 174.369 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 23.5 m80 -59.73 -39.78 85.82 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.211 -176.632 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 57' ' ' GLN . 94.6 mt -58.02 -59.61 5.01 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.387 -177.318 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 58.1 mtmt -72.4 -25.39 61.47 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.401 -176.475 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.61 -49.2 74.24 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 120.954 0.407 . . . . 0.0 110.579 176.711 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -63.83 -37.35 87.05 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.546 -179.207 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.9 -52.97 63.46 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.922 179.115 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 68.7 mt -63.53 -35.35 72.24 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.295 179.503 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.519 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 81.3 t80 -54.96 -63.9 1.01 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.7 177.884 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -63.55 -37.53 87.66 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.813 -173.713 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -81.52 -25.09 36.22 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.811 -173.462 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -130.37 -58.8 1.05 Allowed 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 -174.409 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.519 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 51.2 mm -66.81 -29.05 45.06 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -170.202 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -59.31 144.63 45.89 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.599 -177.506 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 16.9 p -61.63 -58.5 7.84 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.956 0.408 . . . . 0.0 109.928 176.824 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -87.59 85.8 7.13 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 172.083 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -117.03 153.09 49.5 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.932 -175.802 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -74.5 9.58 1.82 Allowed 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 122.811 2.341 . . . . 0.0 112.666 178.59 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.622 ' HE3' ' HA ' ' A' ' 77' ' ' LYS . 0.0 OUTLIER -137.61 -52.59 0.65 Allowed 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 122.457 0.303 . . . . 0.0 110.218 177.568 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 64.81 112.7 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.478 0 O-C-N 123.644 0.59 . . . . 0.0 111.301 -179.621 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 39.7 t -104.34 142.07 18.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.022 -0.535 . . . . 0.0 109.871 179.445 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -78.19 19.93 0.42 Allowed 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.992 0.425 . . . . 0.0 111.0 -180.0 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 28.4 tp -60.29 145.05 48.97 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.223 178.058 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -47.51 128.34 12.35 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.236 176.391 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -61.89 -37.1 83.32 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.93 -176.313 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.432 ' O ' HG23 ' A' ' 88' ' ' VAL . 76.7 t60 -66.57 -35.85 81.23 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.664 0.268 . . . . 0.0 110.454 179.112 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 42.4 m -63.7 -44.43 93.7 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.128 0.489 . . . . 0.0 109.826 174.488 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.465 ' O ' HG23 ' A' ' 90' ' ' THR . 57.9 mtpt -62.38 -35.23 78.53 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.98 176.18 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -62.79 -45.08 94.3 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.793 179.738 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.432 HG23 ' O ' ' A' ' 84' ' ' HIS . 74.9 t -58.44 -43.08 85.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.072 0.463 . . . . 0.0 109.981 177.081 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 70.0 mt -68.65 -41.55 82.79 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.248 -177.896 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.465 HG23 ' O ' ' A' ' 86' ' ' LYS . 43.3 p -62.4 -29.74 70.7 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.837 0.351 . . . . 0.0 111.114 -178.505 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 -85.66 -35.99 20.57 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.032 178.138 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 32.6 t -87.04 -3.46 59.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.438 -0.347 . . . . 0.0 111.485 -176.609 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.1 tp -57.4 -32.3 40.93 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 N-CA-C 111.763 0.283 . . . . 0.0 111.763 -176.436 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 14.6 t -72.98 -31.19 64.37 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 120.739 0.304 . . . . 0.0 110.648 -178.718 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 79.2 mm-40 -142.4 79.11 15.9 Favored Pre-proline 0 C--O 1.233 0.19 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 177.86 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_endo -78.61 157.07 28.35 Favored 'Trans proline' 0 C--O 1.238 0.497 0 C-N-CA 122.614 2.21 . . . . 0.0 112.344 -177.905 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 41.2 p -85.15 179.69 7.19 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.422 177.224 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.411 ' HG ' ' HG3' ' A' ' 51' ' ' LYS . 41.0 tp -57.3 -34.23 68.49 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.607 -176.21 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' HIS . . . . . 0.533 ' O ' ' N ' ' A' ' 101' ' ' PHE . 41.9 m-70 -107.44 -28.75 9.64 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 119.622 -0.228 . . . . 0.0 111.15 177.09 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 47.1 t 52.06 -76.6 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 123.197 0.599 . . . . 0.0 111.694 178.102 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.533 ' N ' ' O ' ' A' ' 99' ' ' HIS . 34.7 m-85 -70.58 5.46 1.84 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.217 0.607 . . . . 0.0 110.981 179.542 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 102' ' ' ASP . . . . . 0.503 ' HB2' ' CB ' ' A' ' 99' ' ' HIS . 12.9 t70 -37.49 -54.49 1.13 Allowed 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.343 0.657 . . . . 0.0 112.249 174.595 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.45 -39.78 80.79 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 121.194 0.521 . . . . 0.0 110.771 -179.533 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.82 -30.73 69.34 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.635 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.411 ' HB3' ' O ' ' A' ' 102' ' ' ASP . 21.7 tm0? -58.66 -51.27 70.66 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.623 178.181 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 22.2 m -59.72 -44.62 93.64 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.67 179.645 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' ARG . . . . . 0.45 ' O ' ' HG ' ' A' ' 111' ' ' LEU . 25.5 mmt180 -55.16 -62.58 1.57 Allowed 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.123 179.41 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 66.2 t -63.02 -37.53 79.6 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.119 -175.641 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 30.1 t80 -55.06 -53.3 57.57 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.966 179.223 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.413 ' HG3' ' O ' ' A' ' 107' ' ' ARG . 5.2 pp0? -71.6 -28.99 64.19 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 121.177 -0.209 . . . . 0.0 110.998 -176.896 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' ' 107' ' ' ARG . 84.5 mt -60.17 -47.62 85.15 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 120.974 0.416 . . . . 0.0 110.219 175.632 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 112' ' ' MET . . . . . 0.449 ' SD ' ' HB ' ' A' ' 41' ' ' ILE . 36.9 mtm -69.56 -37.82 77.18 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.281 178.989 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 113' ' ' GLU . . . . . 0.65 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 40.2 tt0 -58.73 -61.92 2.25 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.695 -177.434 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -53.95 -28.54 37.99 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 -172.28 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -117.91 -61.92 1.62 Allowed 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 -176.19 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 9.2 m -64.7 -34.49 78.42 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.29 -0.414 . . . . 0.0 112.066 -173.583 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' TYR . . . . . 0.65 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 17.9 t80 -64.68 -54.45 31.41 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 120.442 0.163 . . . . 0.0 111.308 -175.503 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 14.2 t -61.65 -34.67 76.11 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.021 0.439 . . . . 0.0 110.435 -179.68 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 32.2 ttt180 -69.12 -37.41 78.33 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.864 179.103 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 82.8 t80 -60.0 -41.02 91.18 Favored 'General case' 0 C--N 1.334 -0.094 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.805 175.916 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 86.9 mt -61.84 -31.54 71.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.561 177.915 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 15.4 tptm -95.55 -2.65 48.05 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.689 -177.206 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 56.4 p -72.56 159.52 33.76 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 120.741 0.305 . . . . 0.0 110.888 -178.709 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -55.12 -34.4 63.68 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.106 175.061 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 68.6 mt -59.41 -53.68 44.82 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.231 -178.23 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 70.0 t80 -68.24 -38.96 82.38 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.656 0.265 . . . . 0.0 110.345 -177.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 93.0 mt -61.99 -32.59 73.07 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 120.882 0.372 . . . . 0.0 110.439 177.892 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -68.39 -35.98 78.48 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.971 176.055 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.46 HD22 HG11 ' A' ' 3' ' ' VAL . 94.0 mt -78.04 -11.93 59.95 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.013 178.899 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 130' ' ' MET . . . . . . . . . . . . . 4.2 mmt -78.88 -72.31 0.39 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.867 178.748 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 40.21 24.79 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.02 0.928 . . . . 0.0 112.918 -176.413 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . -59.69 -61.0 7.71 Favored Glycine 0 C--N 1.335 0.478 0 C-N-CA 121.337 -0.458 . . . . 0.0 112.349 -176.753 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 133' ' ' ARG . . . . . 0.447 ' O ' ' HG3' ' A' ' 133' ' ' ARG . 24.9 ptt85 -138.39 88.75 14.47 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-O 121.209 0.528 . . . . 0.0 110.503 177.95 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo . . . . . 0 CA--C 1.531 0.35 0 C-N-CA 122.775 2.317 . . . . 0.0 111.415 176.524 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 47.7 t . . . . . 0 N--CA 1.478 0.931 0 CA-C-O 120.565 0.222 . . . . 0.0 110.956 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' MET . . . . . 0.429 ' C ' ' SD ' ' A' ' 2' ' ' MET . 0.3 OUTLIER -99.23 123.96 43.92 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 120.888 0.375 . . . . 0.0 110.579 -175.055 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.461 HG21 ' CH2' ' A' ' 11' ' ' TRP . 3.1 p -156.92 141.35 8.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.362 179.051 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.0 p -103.36 148.77 36.21 Favored Pre-proline 0 C--N 1.327 -0.383 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 175.096 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_exo -51.78 -24.89 19.36 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 122.836 2.357 . . . . 0.0 112.617 178.355 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.05 -40.92 95.45 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.406 0.622 . . . . 0.0 109.5 176.102 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.41 ' HB3' HG23 ' A' ' 3' ' ' VAL . 9.3 tp10 -74.0 -30.25 62.37 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.803 176.616 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.17 -52.68 61.42 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.727 178.784 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 27.0 m -65.1 -27.01 41.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.487 177.035 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.557 ' O ' ' HD2' ' A' ' 17' ' ' LYS . 5.0 tppt? -61.71 -46.5 89.41 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 175.84 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.461 ' CH2' HG21 ' A' ' 3' ' ' VAL . 47.9 m0 -59.64 -28.81 67.56 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.44 177.507 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -60.3 -17.23 45.72 Favored Glycine 0 C--N 1.334 0.452 0 CA-C-N 115.602 -0.726 . . . . 0.0 112.465 177.885 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -76.22 -48.51 20.09 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 120.727 0.299 . . . . 0.0 110.952 177.622 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 38.8 m -146.35 121.71 10.29 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-O 121.064 0.459 . . . . 0.0 112.161 -172.23 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.414 ' O ' HD13 ' A' ' 19' ' ' LEU . 22.4 t80 -52.05 -28.38 17.11 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.093 174.303 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -54.27 -58.52 7.09 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.454 175.946 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.557 ' HD2' ' O ' ' A' ' 10' ' ' LYS . 0.4 OUTLIER -72.15 -16.77 61.98 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.849 -174.058 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 63.0 tp -65.85 -42.91 89.86 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 121.107 0.479 . . . . 0.0 109.764 171.316 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.414 HD13 ' O ' ' A' ' 15' ' ' PHE . 2.7 mp -78.63 -42.43 28.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.529 -176.713 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.553 ' OG ' ' HA ' ' A' ' 17' ' ' LYS . 12.7 p -65.91 -22.94 66.54 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 120.88 0.371 . . . . 0.0 111.091 -178.379 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -82.66 108.92 16.4 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 174.964 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.5 ptm180 -40.81 -37.33 0.75 Allowed 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.011 0.524 . . . . 0.0 111.806 177.434 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -77.34 -35.31 54.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.133 -178.678 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -68.59 -51.88 28.56 Favored Glycine 0 C--N 1.331 0.259 0 N-CA-C 111.417 -0.673 . . . . 0.0 111.417 179.519 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.7 tt -55.55 -37.4 67.93 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.846 -0.428 . . . . 0.0 109.846 174.233 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.564 ' O ' ' HG3' ' A' ' 30' ' ' ARG . 43.0 tt0 -62.34 -47.82 82.55 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.674 178.709 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -66.57 -40.52 89.01 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.108 0.48 . . . . 0.0 110.327 179.123 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -65.34 -41.53 93.83 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.958 -177.013 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.476 HG22 ' O ' ' A' ' 26' ' ' GLU . 10.4 t -66.36 -36.11 82.05 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 120.559 0.219 . . . . 0.0 110.693 -179.0 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.564 ' HG3' ' O ' ' A' ' 26' ' ' GLU . 49.3 mtt180 -59.27 -43.57 92.48 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 121.17 0.51 . . . . 0.0 110.067 177.166 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.582 ' O ' HG22 ' A' ' 34' ' ' THR . 87.9 t80 -72.81 -46.67 51.91 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.778 -179.819 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 20.8 tp -60.28 -26.37 66.43 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.575 -173.278 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.411 ' NZ ' ' OG1' ' A' ' 29' ' ' THR . 46.5 mttp -66.12 -18.57 65.43 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 112.276 0.473 . . . . 0.0 112.276 -179.522 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.582 HG22 ' O ' ' A' ' 31' ' ' PHE . 5.9 t -77.09 -21.06 54.91 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 120.68 0.276 . . . . 0.0 110.84 -179.171 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -111.66 -7.07 14.28 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.965 -178.654 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 62.02 17.29 8.91 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.87 -0.605 . . . . 0.0 112.036 175.681 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 32.0 t -78.47 6.54 8.31 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.479 0.656 . . . . 0.0 110.128 178.246 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -64.2 -19.16 65.15 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.605 -176.378 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -58.61 -29.08 66.2 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 121.104 0.478 . . . . 0.0 110.178 177.681 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.602 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 90.5 m-20 -73.82 -50.39 20.66 Favored 'General case' 0 C--O 1.242 0.678 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.029 -179.215 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.473 HG13 ' CZ2' ' A' ' 44' ' ' TRP . 13.3 tt -63.96 -42.36 95.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 -179.816 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.54 ' HA ' ' HB ' ' A' ' 45' ' ' ILE . 48.8 mt-10 -65.92 -26.48 67.62 Favored 'General case' 0 N--CA 1.461 0.124 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.77 177.962 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.602 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 37.9 t80 -56.6 -61.35 2.48 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 116.583 -0.28 . . . . 0.0 110.291 175.869 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.473 ' CZ2' HG13 ' A' ' 41' ' ' ILE . 39.9 p-90 -78.68 -18.29 54.61 Favored 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 119.432 -0.907 . . . . 0.0 111.555 -178.072 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.54 ' HB ' ' HA ' ' A' ' 42' ' ' GLU . 24.0 mt -64.13 -37.37 79.7 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.287 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 169.771 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.04 -35.61 81.28 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.7 174.849 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.83 ' SG ' ' HB2' ' A' ' 101' ' ' PHE . 41.6 t -64.89 -36.09 83.23 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.819 175.131 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.598 ' HA ' ' HB3' ' A' ' 51' ' ' LYS . 15.7 mt-10 -77.95 -25.02 47.98 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 121.009 -0.276 . . . . 0.0 110.56 177.851 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -64.34 -38.56 91.48 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.851 0.834 . . . . 0.0 108.816 171.005 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -64.73 -37.74 88.62 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.405 -1.271 . . . . 0.0 110.102 172.462 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.598 ' HB3' ' HA ' ' A' ' 48' ' ' GLU . 4.7 tmtm? -70.59 -23.1 62.51 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.473 178.65 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.481 ' HG3' ' O ' ' A' ' 48' ' ' GLU . 57.6 mtpt -57.83 -37.11 73.25 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.164 0.507 . . . . 0.0 110.779 177.25 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.414 ' CB ' ' HG2' ' A' ' 58' ' ' GLN . 10.2 p -91.11 154.26 19.49 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.076 -177.055 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.01 9.66 4.9 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.977 -179.13 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' GLY . . . . . 0.436 ' O ' HG12 ' A' ' 59' ' ' ILE . . . -83.28 121.23 5.41 Favored Glycine 0 C--N 1.332 0.356 0 N-CA-C 111.465 -0.654 . . . . 0.0 111.465 176.167 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_endo -55.34 -31.7 78.19 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 122.871 2.381 . . . . 0.0 112.768 -174.284 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' GLN . . . . . 0.51 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 24.6 mp0 -67.12 -51.33 55.36 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 176.897 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.414 ' HG2' ' CB ' ' A' ' 53' ' ' SER . 7.9 tp60 -55.27 -38.92 69.2 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.414 179.008 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.436 HG12 ' O ' ' A' ' 55' ' ' GLY . 39.9 mm -52.3 -57.82 3.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.056 179.757 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 76.3 m80 -64.37 -37.52 87.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.556 -0.293 . . . . 0.0 111.094 -176.798 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 57' ' ' GLN . 89.0 mt -58.26 -60.9 3.04 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-O 120.865 0.364 . . . . 0.0 110.962 -179.141 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -65.37 -45.24 84.88 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.234 -177.395 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.8 -49.26 77.21 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.82 0.343 . . . . 0.0 111.333 -178.104 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -66.26 -30.77 71.28 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.488 -177.391 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -69.73 -53.98 15.88 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.527 178.375 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 74.3 mt -58.21 -35.49 53.42 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 CA-C-O 121.324 0.583 . . . . 0.0 110.078 177.799 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 85.5 t80 -56.04 -58.27 8.6 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.622 177.969 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -71.63 -25.42 62.15 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.092 -0.504 . . . . 0.0 112.218 -175.752 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 65.7 tttp -86.78 -29.02 22.63 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 111.566 0.21 . . . . 0.0 111.566 -176.705 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -127.76 -53.94 1.33 Allowed 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -174.754 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 45.2 mm -71.51 -19.77 20.69 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 CA-C-O 120.77 0.319 . . . . 0.0 111.575 -171.238 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.501 ' HB3' ' HB2' ' A' ' 75' ' ' ALA . 53.9 tp60 -51.74 135.89 28.5 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.811 178.544 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 19.3 p -50.8 -49.79 57.65 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.942 -176.119 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -85.89 -62.89 1.42 Allowed 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 174.991 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.501 ' HB2' ' HB3' ' A' ' 72' ' ' GLN . . . 60.09 158.57 0.11 Allowed Pre-proline 0 N--CA 1.469 0.485 0 C-N-CA 122.996 0.518 . . . . 0.0 112.253 176.316 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -70.18 -23.76 28.53 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.218 1.945 . . . . 0.0 111.26 173.097 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -95.81 -41.11 9.0 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.079 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 55.81 88.52 0.04 OUTLIER 'General case' 0 C--O 1.234 0.266 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 -172.142 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.477 HG12 ' H ' ' A' ' 81' ' ' LEU . 24.3 t -90.91 126.34 43.64 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.683 -172.499 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 37.1 m-80 -74.73 15.89 0.33 Allowed 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.591 -177.442 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.477 ' H ' HG12 ' A' ' 79' ' ' VAL . 16.8 tp -57.17 146.97 26.23 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.212 -0.449 . . . . 0.0 109.883 174.734 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -46.89 131.07 12.12 Favored 'General case' 0 C--O 1.237 0.414 0 O-C-N 123.606 0.566 . . . . 0.0 112.39 -176.524 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 36.6 p90 -55.94 -44.98 78.89 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.155 -0.93 . . . . 0.0 111.744 -177.39 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.455 ' O ' HG23 ' A' ' 88' ' ' VAL . 81.1 t60 -67.92 -32.83 73.56 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.83 0.348 . . . . 0.0 110.32 -176.661 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 49.7 m -65.86 -47.19 75.75 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.025 176.696 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.421 ' HE2' ' O ' ' A' ' 81' ' ' LEU . 58.0 mtmt -65.06 -30.72 71.7 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.151 176.959 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -63.52 -50.0 71.31 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.827 179.035 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.455 HG23 ' O ' ' A' ' 84' ' ' HIS . 91.8 t -56.77 -44.91 82.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 121.003 0.43 . . . . 0.0 110.173 178.489 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 70.5 mt -63.22 -47.43 92.3 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.073 -178.768 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 20.2 p -61.64 -26.07 67.77 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 120.763 0.316 . . . . 0.0 111.681 -176.941 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 42.0 m-80 -94.85 -14.69 24.35 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 111.663 0.245 . . . . 0.0 111.663 178.907 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 33.0 m -108.45 -4.77 17.03 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 111.664 0.246 . . . . 0.0 111.664 -177.873 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.448 ' O ' ' HD3' ' A' ' 96' ' ' PRO . 9.6 tp -61.35 -18.72 18.99 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 CA-C-O 120.878 0.371 . . . . 0.0 111.363 -177.757 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.524 HG23 ' HG2' ' A' ' 95' ' ' GLN . 8.9 t -60.72 -29.55 69.43 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.595 177.667 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.524 ' HG2' HG23 ' A' ' 94' ' ' THR . 12.8 pt20 -149.2 77.44 9.05 Favored Pre-proline 0 CA--C 1.532 0.288 0 CA-C-O 121.351 0.596 . . . . 0.0 110.172 178.123 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.448 ' HD3' ' O ' ' A' ' 93' ' ' ILE . 72.3 Cg_endo -73.78 129.76 13.86 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.602 2.201 . . . . 0.0 112.125 -178.033 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 68.7 p -85.04 175.3 9.11 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.29 177.615 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 31.1 tp -60.56 -19.12 56.5 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 121.434 0.635 . . . . 0.0 110.675 -179.118 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' HIS . . . . . 0.79 ' HB3' ' HB2' ' A' ' 102' ' ' ASP . 28.5 m-70 -128.49 39.16 3.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.987 178.226 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 22.4 t -59.41 -30.99 68.86 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.121 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.83 ' HB2' ' SG ' ' A' ' 47' ' ' CYS . 59.0 m-85 -104.38 19.74 19.72 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.578 -178.704 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 102' ' ' ASP . . . . . 0.79 ' HB2' ' HB3' ' A' ' 99' ' ' HIS . 24.2 t70 -58.88 -43.07 90.84 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.265 -175.786 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.463 ' O ' ' HG2' ' A' ' 107' ' ' ARG . . . -68.66 -41.29 79.51 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.105 179.232 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -58.42 -39.9 81.05 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.166 178.035 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.463 ' HG2' ' HB2' ' A' ' 44' ' ' TRP . 23.0 tm0? -57.54 -51.27 70.15 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.769 177.833 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 36.3 t -63.61 -37.08 85.98 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.159 -178.102 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' ARG . . . . . 0.529 ' O ' ' HG ' ' A' ' 111' ' ' LEU . 12.3 mmm180 -67.25 -46.88 72.41 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.504 0.192 . . . . 0.0 111.095 -178.553 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 61.4 t -68.85 -34.99 67.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 121.348 0.594 . . . . 0.0 109.927 177.94 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -55.49 -51.75 65.94 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.548 175.087 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.478 ' O ' ' HG2' ' A' ' 114' ' ' GLN . 13.7 pt20 -69.68 -29.67 67.16 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.068 -177.819 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 107' ' ' ARG . 80.9 mt -63.02 -43.55 98.42 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 120.907 0.384 . . . . 0.0 110.465 177.295 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 43.5 mtm -74.27 -28.52 61.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.024 0.44 . . . . 0.0 110.06 177.605 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' GLU . . . . . 0.609 ' HA ' ' HB3' ' A' ' 117' ' ' TYR . 8.2 tm-20 -60.28 -65.48 0.68 Allowed 'General case' 0 C--O 1.236 0.373 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.333 179.211 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 114' ' ' GLN . . . . . 0.478 ' HG2' ' O ' ' A' ' 110' ' ' GLN . 14.6 pt20 -56.22 -28.7 59.33 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 -174.468 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -105.91 -62.38 1.38 Allowed 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -176.473 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 12.9 m -75.93 -37.95 58.17 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 111.933 0.345 . . . . 0.0 111.933 -173.346 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 117' ' ' TYR . . . . . 0.609 ' HB3' ' HA ' ' A' ' 113' ' ' GLU . 25.6 t80 -72.83 -40.43 65.77 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.775 -0.193 . . . . 0.0 111.136 -174.328 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 24.6 p -57.57 -53.22 60.68 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-O 121.368 0.604 . . . . 0.0 109.851 175.653 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' ARG . . . . . 0.436 HH11 ' HD3' ' A' ' 119' ' ' ARG . 28.9 mtp-105 -58.75 -38.47 78.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.007 177.119 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -61.6 -39.18 90.31 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.735 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.488 HD11 ' CZ ' ' A' ' 117' ' ' TYR . 82.4 mt -70.09 -27.24 64.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.816 0.341 . . . . 0.0 110.88 179.167 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 122' ' ' LYS . . . . . 0.76 ' HE3' ' HA ' ' A' ' 122' ' ' LYS . 0.2 OUTLIER -100.41 1.49 41.37 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.112 -178.979 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 83.5 p -64.68 148.14 51.62 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 120.778 0.323 . . . . 0.0 110.838 -177.587 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -63.06 -35.28 79.71 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.523 -178.602 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 6.4 tp -64.12 -40.37 88.8 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.864 178.002 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 83.2 t80 -60.34 -43.09 96.77 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.145 0.498 . . . . 0.0 109.893 178.28 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 69.4 mt -66.12 -31.52 72.42 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.436 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -64.84 -38.77 92.09 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.997 176.676 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 86.6 mt -61.7 -40.71 95.98 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.927 175.893 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 130' ' ' MET . . . . . . . . . . . . . 86.9 mmm -64.72 -33.88 77.0 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.412 179.45 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 -59.28 -27.06 65.49 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.353 176.152 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . -60.75 -36.27 91.47 Favored Glycine 0 N--CA 1.45 -0.409 0 CA-C-N 115.951 -0.568 . . . . 0.0 112.096 177.841 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 33.1 mtm180 64.7 147.35 0.1 OUTLIER Pre-proline 0 CA--C 1.536 0.431 0 C-N-CA 122.887 0.475 . . . . 0.0 111.22 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_exo . . . . . 0 C--N 1.347 0.492 0 C-N-CA 122.536 2.158 . . . . 0.0 112.286 -179.738 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 20.2 m . . . . . 0 N--CA 1.477 0.914 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 27.6 ttt -89.49 101.98 14.66 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 109.149 -0.685 . . . . 0.0 109.149 173.842 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.5 p -83.84 139.33 17.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.239 -177.534 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.0 m -86.72 148.25 45.62 Favored Pre-proline 0 CA--C 1.534 0.33 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 175.286 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -53.63 -30.63 56.27 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.743 2.295 . . . . 0.0 113.04 -173.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 28.5 tp10 -60.52 -43.15 97.45 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 121.173 0.511 . . . . 0.0 110.303 177.155 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -76.55 -32.5 58.24 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.944 179.478 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.14 -49.91 70.28 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.848 179.19 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 33.7 m -66.9 -28.34 42.69 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 177.539 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.568 ' O ' ' HD2' ' A' ' 17' ' ' LYS . 8.4 tppt? -57.85 -48.85 78.59 Favored 'General case' 0 CA--C 1.527 0.094 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.388 176.523 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.437 ' HB3' HD13 ' A' ' 18' ' ' LEU . 49.1 m0 -59.54 -33.11 70.97 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.505 178.224 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -69.11 -8.18 58.07 Favored Glycine 0 C--N 1.331 0.281 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.903 -178.607 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -79.37 -34.14 42.29 Favored 'General case' 0 C--N 1.33 -0.248 0 O-C-N 122.839 -0.212 . . . . 0.0 110.618 177.647 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.477 ' HB3' ' HG2' ' A' ' 17' ' ' LYS . 35.5 t -161.0 129.26 4.43 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 120.996 0.427 . . . . 0.0 111.56 -176.01 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.45 ' O ' HD13 ' A' ' 19' ' ' LEU . 10.1 t80 -58.23 -27.61 64.1 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.597 175.775 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -60.78 -48.71 80.56 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.048 177.951 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.568 ' HD2' ' O ' ' A' ' 10' ' ' LYS . 19.3 ptpt -80.19 -11.74 59.71 Favored 'General case' 0 C--O 1.233 0.192 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.796 -177.007 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.437 HD13 ' HB3' ' A' ' 11' ' ' TRP . 60.0 tp -69.0 -45.93 69.32 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 170.411 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.45 HD13 ' O ' ' A' ' 15' ' ' PHE . 8.0 mp -61.83 -30.31 70.75 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.839 176.268 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.4 t -58.12 -21.13 45.19 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.168 178.439 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' HIS . . . . . 0.474 ' HB3' ' H ' ' A' ' 24' ' ' GLY . 0.8 OUTLIER -102.41 136.5 42.12 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 176.634 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.03 -47.56 50.89 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 121.137 0.494 . . . . 0.0 110.098 177.329 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 30.2 p-10 -69.78 -33.9 73.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.277 178.897 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.474 ' H ' ' HB3' ' A' ' 21' ' ' HIS . . . -64.14 -45.5 93.57 Favored Glycine 0 C--N 1.333 0.377 0 N-CA-C 111.388 -0.685 . . . . 0.0 111.388 173.363 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.5 tp -53.38 -52.4 59.41 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.365 0.603 . . . . 0.0 110.158 174.067 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.644 ' O ' ' HG2' ' A' ' 30' ' ' ARG . 27.9 tt0 -60.33 -42.4 95.56 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.514 -177.663 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.4 ' O ' ' HB2' ' A' ' 30' ' ' ARG . . . -55.21 -47.3 75.51 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-O 121.28 0.562 . . . . 0.0 110.134 177.669 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 90.6 t80 -59.92 -49.09 79.04 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.633 178.236 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.563 HG22 ' HA ' ' A' ' 26' ' ' GLU . 6.0 t -65.88 -24.57 66.88 Favored 'General case' 0 C--O 1.225 -0.211 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.571 -177.243 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.644 ' HG2' ' O ' ' A' ' 26' ' ' GLU . 31.5 mmt180 -57.56 -48.96 77.91 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 173.391 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.601 ' O ' HG22 ' A' ' 34' ' ' THR . 86.5 t80 -69.73 -33.83 73.02 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.655 178.434 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.46 HD23 ' HB ' ' A' ' 41' ' ' ILE . 27.5 tp -72.71 -26.19 61.5 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 121.005 0.431 . . . . 0.0 110.916 -178.241 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.491 ' HG3' ' O ' ' A' ' 29' ' ' THR . 28.2 mtpp -75.4 -38.29 59.97 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.091 179.652 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.601 HG22 ' O ' ' A' ' 31' ' ' PHE . 12.0 t -68.18 -15.96 63.79 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 120.804 0.335 . . . . 0.0 110.825 -176.689 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -109.55 23.78 13.97 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.265 175.437 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 50.4 p90 45.12 26.24 0.22 Allowed 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.603 1.161 . . . . 0.0 113.587 174.893 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 10.4 t -108.04 20.13 19.11 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.043 0.449 . . . . 0.0 110.193 -179.219 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.631 ' O ' HG22 ' A' ' 41' ' ' ILE . 10.2 pt-20 -63.34 -22.44 66.88 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.564 -176.603 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -53.02 -26.37 15.3 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.662 0.268 . . . . 0.0 111.263 -179.584 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.433 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 8.4 m120 -67.12 -49.7 63.99 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-O 121.047 0.451 . . . . 0.0 110.447 177.761 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.631 HG22 ' O ' ' A' ' 38' ' ' GLU . 6.3 tp -63.85 -42.75 96.87 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.122 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.197 -176.555 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -71.63 -25.84 62.32 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.26 -178.193 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.445 ' HE1' ' HB3' ' A' ' 70' ' ' PHE . 41.3 t80 -60.57 -67.86 0.36 Allowed 'General case' 0 C--O 1.237 0.412 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.969 179.483 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.512 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 35.6 p-90 -75.96 -23.57 55.36 Favored 'General case' 0 C--O 1.225 -0.187 0 C-N-CA 119.402 -0.919 . . . . 0.0 111.954 -174.821 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 26.4 mt -57.9 -38.67 67.58 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 C-N-CA 120.405 -0.518 . . . . 0.0 109.769 172.237 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.407 ' O ' ' HB2' ' A' ' 49' ' ' ASP . . . -66.03 -37.24 85.39 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 121.137 0.494 . . . . 0.0 110.034 175.19 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.575 ' O ' ' HB3' ' A' ' 50' ' ' PHE . 71.6 m -72.15 -17.17 61.98 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.297 177.685 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.512 ' HG2' ' O ' ' A' ' 44' ' ' TRP . 12.3 mm-40 -73.98 -37.36 64.48 Favored 'General case' 0 C--O 1.225 -0.22 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 171.286 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.461 ' O ' ' HB2' ' A' ' 52' ' ' LYS . 5.8 m-20 -59.12 -29.77 67.64 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 172.149 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.575 ' HB3' ' O ' ' A' ' 47' ' ' CYS . 85.2 t80 -64.43 -40.61 96.08 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.971 173.875 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.566 ' HE3' ' CE1' ' A' ' 99' ' ' HIS . 60.0 mttp -58.87 -31.78 68.87 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.091 0.472 . . . . 0.0 110.236 173.552 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.56 ' N ' ' HE2' ' A' ' 52' ' ' LYS . 1.1 mpmm? -70.1 -24.73 63.25 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.419 -179.851 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.475 ' HB3' ' HG3' ' A' ' 58' ' ' GLN . 39.1 m -60.73 127.42 31.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.714 0.768 . . . . 0.0 110.963 -177.289 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 28.5 tptp -110.58 128.7 55.77 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 114.647 -1.161 . . . . 0.0 110.152 -176.072 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 100.68 131.64 7.46 Favored Glycine 0 CA--C 1.519 0.282 0 N-CA-C 111.701 -0.56 . . . . 0.0 111.701 -178.292 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -54.54 -46.52 32.84 Favored 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 122.794 2.329 . . . . 0.0 111.847 -178.492 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -53.7 -48.0 69.96 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.058 0.456 . . . . 0.0 110.282 178.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.475 ' HG3' ' HB3' ' A' ' 53' ' ' SER . 8.4 tp-100 -55.57 -42.77 75.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.121 177.033 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.537 HG22 ' HG2' ' A' ' 96' ' ' PRO . 47.5 mm -60.85 -39.9 83.44 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.024 179.334 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 74.7 m80 -61.93 -55.02 33.84 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 120.673 0.273 . . . . 0.0 110.854 -179.207 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.539 HD12 ' N ' ' A' ' 62' ' ' LYS . 4.2 pp -67.69 -35.66 79.23 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.357 -176.217 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.539 ' N ' HD12 ' A' ' 61' ' ' LEU . 32.0 mmtp -65.67 -38.8 90.31 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 120.946 0.403 . . . . 0.0 110.005 176.363 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.83 -49.03 79.13 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.751 179.68 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 53.7 mmtt -54.26 -43.07 70.64 Favored 'General case' 0 N--CA 1.466 0.351 0 O-C-N 123.273 0.358 . . . . 0.0 111.191 178.256 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.02 -61.07 2.55 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.064 -179.895 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 63.9 mt -64.08 -37.6 80.27 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-O 121.334 0.588 . . . . 0.0 110.586 -178.78 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -57.24 -57.39 12.84 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.179 -177.135 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -78.15 -23.04 47.9 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.919 -172.796 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -99.76 -16.82 17.98 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -174.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.445 ' HB3' ' HE1' ' A' ' 43' ' ' PHE . 97.3 m-85 -132.56 -49.17 0.9 Allowed 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 -176.405 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 50.6 mm -74.89 -32.51 27.88 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -169.725 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 51.2 mm-40 -64.67 143.44 57.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.98 0.419 . . . . 0.0 111.556 179.818 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 22.1 m -62.46 -28.94 70.17 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.212 177.223 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -98.47 24.43 7.38 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.501 -178.211 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -89.57 152.31 47.03 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.58 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_exo -67.34 15.81 0.13 Allowed 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 123.248 2.632 . . . . 0.0 113.732 -177.165 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -130.4 -27.21 2.21 Favored 'General case' 0 C--N 1.331 -0.238 0 O-C-N 122.333 -0.229 . . . . 0.0 111.236 177.852 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 48.73 42.21 19.27 Favored 'General case' 0 N--CA 1.466 0.353 0 O-C-N 123.498 0.499 . . . . 0.0 110.937 177.055 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 58.3 t -47.47 133.34 4.42 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 CA-C-N 115.264 -0.88 . . . . 0.0 111.848 -174.653 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -70.84 76.46 0.62 Allowed 'General case' 0 C--O 1.237 0.413 0 CA-C-O 121.283 0.563 . . . . 0.0 110.911 -178.558 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.569 HD23 ' HB3' ' A' ' 86' ' ' LYS . 55.2 tp -113.79 144.68 42.59 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.32 -0.854 . . . . 0.0 109.918 177.075 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -67.2 145.73 54.92 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 120.815 0.341 . . . . 0.0 110.91 178.644 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 91.7 t80 -58.32 -50.85 72.16 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.465 -176.602 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.438 ' O ' ' HB3' ' A' ' 87' ' ' GLU . 85.7 t60 -61.14 -33.26 73.12 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.615 0.245 . . . . 0.0 111.176 -175.61 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 25.7 m -69.03 -50.13 51.43 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.805 0.336 . . . . 0.0 110.79 178.671 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.569 ' HB3' HD23 ' A' ' 81' ' ' LEU . 12.2 ptmm? -70.69 -19.96 62.73 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.084 0.468 . . . . 0.0 110.295 178.645 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.438 ' HB3' ' O ' ' A' ' 84' ' ' HIS . 37.1 tt0 -61.84 -54.77 37.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.613 173.6 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 84' ' ' HIS . 59.2 t -55.01 -41.24 57.65 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.215 178.077 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 73.2 mt -60.15 -53.21 51.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.118 179.722 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.522 HG23 ' O ' ' A' ' 86' ' ' LYS . 66.7 p -58.48 -30.57 67.1 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 120.799 0.333 . . . . 0.0 111.596 -176.173 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 41.8 m-80 -83.53 -29.56 27.79 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.492 -179.521 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 16.1 m -101.14 -0.99 35.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.711 0.291 . . . . 0.0 111.4 -175.55 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.5 tp -61.97 -21.2 25.61 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-O 120.851 0.358 . . . . 0.0 111.357 -176.65 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 9.5 t -62.64 -37.83 87.89 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.623 179.255 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -138.83 77.15 33.14 Favored Pre-proline 0 C--O 1.234 0.272 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.259 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.537 ' HG2' HG22 ' A' ' 59' ' ' ILE . 72.8 Cg_endo -76.92 151.76 31.43 Favored 'Trans proline' 0 C--O 1.235 0.374 0 C-N-CA 122.649 2.232 . . . . 0.0 112.102 -178.173 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' THR . . . . . 0.455 HG22 ' H ' ' A' ' 98' ' ' LEU . 5.8 m -96.43 168.71 10.39 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 116.035 -0.529 . . . . 0.0 109.823 178.353 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.455 ' H ' HG22 ' A' ' 97' ' ' THR . 61.1 tp -45.79 -36.61 5.29 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 -175.275 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' HIS . . . . . 0.791 ' HB3' ' HB2' ' A' ' 102' ' ' ASP . 55.1 m-70 -98.13 -52.5 3.67 Favored 'General case' 0 N--CA 1.464 0.242 0 O-C-N 122.25 -0.281 . . . . 0.0 110.852 -179.255 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 33.2 t 51.5 -81.94 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.105 0.562 . . . . 0.0 112.507 174.923 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' PHE . . . . . 0.444 ' N ' ' O ' ' A' ' 99' ' ' HIS . 50.4 m-85 -74.55 -1.55 21.91 Favored 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 122.635 0.374 . . . . 0.0 111.287 -174.981 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 102' ' ' ASP . . . . . 0.791 ' HB2' ' HB3' ' A' ' 99' ' ' HIS . 8.0 t70 -51.52 -43.53 62.3 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.44 -176.205 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.33 -41.29 88.8 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 121.256 0.551 . . . . 0.0 110.373 177.269 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.09 -36.35 83.73 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.348 178.181 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.443 ' OE1' ' SG ' ' A' ' 47' ' ' CYS . 15.9 mm-40 -66.38 -36.84 83.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.449 179.583 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 52.0 m -62.06 -35.4 78.51 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.573 177.399 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' ARG . . . . . 0.514 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 0.0 OUTLIER -60.69 -49.47 77.4 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-O 121.025 0.441 . . . . 0.0 110.06 178.228 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.485 HG12 ' SD ' ' A' ' 112' ' ' MET . 96.7 t -64.28 -46.0 94.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.285 178.022 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -52.5 -47.06 66.82 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.601 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' GLN . . . . . 0.514 ' HG3' ' O ' ' A' ' 107' ' ' ARG . 0.0 OUTLIER -70.64 -31.06 67.85 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 121.139 -0.224 . . . . 0.0 110.773 -176.077 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 95.2 mt -62.58 -49.0 77.0 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.482 0.658 . . . . 0.0 109.339 172.831 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' MET . . . . . 0.485 ' SD ' HG12 ' A' ' 108' ' ' VAL . 66.0 mtp -60.42 -38.17 83.21 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.296 178.811 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 113' ' ' GLU . . . . . 0.613 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 39.7 tt0 -61.23 -65.72 0.65 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.718 -178.825 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 114' ' ' GLN . . . . . 0.405 ' HG2' ' O ' ' A' ' 110' ' ' GLN . 4.9 pt20 -60.93 -32.34 71.84 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.861 -174.426 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -90.4 -70.29 0.68 Allowed 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 -177.714 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 4.7 p -86.28 -25.01 25.72 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 -169.115 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' TYR . . . . . 0.613 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 38.2 t80 -71.55 -41.08 69.55 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 118.398 0.545 . . . . 0.0 110.659 -178.407 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 31.6 p -60.35 -51.99 67.17 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 121.321 0.581 . . . . 0.0 110.141 176.799 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 43.2 mtm-85 -59.03 -36.04 74.31 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.445 177.434 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 65.7 t80 -62.78 -38.09 89.25 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.616 177.442 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 82.5 mt -65.35 -27.22 68.43 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.788 0.327 . . . . 0.0 110.641 178.583 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 122' ' ' LYS . . . . . 0.783 ' HE2' ' HA ' ' A' ' 122' ' ' LYS . 10.4 mmpt? -102.6 1.83 35.28 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.784 178.729 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 123' ' ' SER . . . . . 0.457 ' OG ' HG22 ' A' ' 125' ' ' ILE . 79.0 p -72.96 143.16 47.74 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.749 0.309 . . . . 0.0 110.707 -179.352 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -59.99 -25.98 65.69 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.213 178.872 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.474 HD13 ' O ' ' A' ' 125' ' ' ILE . 0.0 OUTLIER -67.27 -36.64 77.27 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 177.854 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 84.0 t80 -64.61 -38.45 91.06 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 121.068 0.461 . . . . 0.0 109.913 174.696 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.528 HD13 ' HG3' ' A' ' 130' ' ' MET . 4.4 mm? -65.17 -22.59 66.93 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.751 177.027 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 128' ' ' ASP . . . . . 0.41 ' HB3' ' O ' ' A' ' 125' ' ' ILE . 24.8 t70 -73.9 -33.44 64.0 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 121.193 0.521 . . . . 0.0 109.683 173.96 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 66.9 mt -72.76 -23.38 60.81 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.796 178.09 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 130' ' ' MET . . . . . 0.528 ' HG3' HD13 ' A' ' 127' ' ' LEU . 2.4 mmt -60.72 -69.54 0.22 Allowed 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.954 179.997 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 52.39 34.47 15.17 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 121.867 0.841 . . . . 0.0 109.844 -177.712 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . -84.15 61.06 4.77 Favored Glycine 0 N--CA 1.45 -0.39 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.96 -178.513 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 24.1 ttm180 -76.69 117.14 62.63 Favored Pre-proline 0 C--N 1.327 -0.389 0 C-N-CA 122.259 0.224 . . . . 0.0 110.438 179.221 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo . . . . . 0 C--N 1.347 0.48 0 C-N-CA 122.644 2.229 . . . . 0.0 112.757 -179.742 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 48.2 t . . . . . 0 N--CA 1.481 1.097 0 CA-C-O 120.68 0.276 . . . . 0.0 110.313 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 26.9 ptt? -64.43 127.01 29.66 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.032 177.65 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.2 p -93.44 143.61 11.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 120.776 0.322 . . . . 0.0 110.885 -178.403 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 49.8 m -80.02 141.87 55.11 Favored Pre-proline 0 C--O 1.236 0.349 0 CA-C-N 116.148 -0.478 . . . . 0.0 109.996 176.136 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -51.39 -35.01 52.91 Favored 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 122.804 2.336 . . . . 0.0 112.898 -177.14 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.526 ' O ' ' HG2' ' A' ' 10' ' ' LYS . 14.5 mm-40 -69.0 -34.68 75.67 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.991 -179.359 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 23.4 mm-40 -71.44 -32.79 68.75 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 172.956 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.35 -42.81 98.95 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.706 178.944 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.483 HG22 ' O ' ' A' ' 6' ' ' GLU . 17.4 m -69.71 -28.31 36.79 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-O 120.98 0.419 . . . . 0.0 110.087 176.914 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.541 ' HA ' ' HG2' ' A' ' 13' ' ' GLU . 71.6 mmtt -66.56 -31.06 71.53 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.368 174.981 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.437 ' CD1' ' HG2' ' A' ' 17' ' ' LYS . 48.2 m0 -62.24 -25.75 68.0 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 173.183 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -79.85 -22.99 62.76 Favored Glycine 0 C--N 1.333 0.405 0 CA-C-N 115.565 -0.743 . . . . 0.0 112.927 -178.551 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.541 ' HG2' ' HA ' ' A' ' 10' ' ' LYS . 8.2 pt-20 -101.88 -18.07 15.89 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.821 0.31 . . . . 0.0 110.871 178.278 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 42.1 m -134.8 96.97 3.65 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.893 0.377 . . . . 0.0 111.519 -177.779 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -58.28 -34.13 70.18 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 175.781 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -54.55 -48.94 71.41 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.802 174.367 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.451 ' HD2' ' HB3' ' A' ' 10' ' ' LYS . 22.0 ttmm -67.22 -35.24 79.17 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.8 -177.494 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 67.1 tp -57.63 -49.58 75.96 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.066 -0.516 . . . . 0.0 109.924 176.453 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.5 mp -73.45 -30.26 63.08 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.966 179.748 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 26.0 t -63.73 -41.12 98.11 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.194 179.666 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 21.1 m-70 -77.49 115.88 17.61 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 175.886 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.411 ' HD2' ' N ' ' A' ' 22' ' ' ARG . 8.3 mpt_? -53.15 -35.26 59.56 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 120.86 0.362 . . . . 0.0 110.667 -177.852 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -66.25 -42.99 87.76 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.378 177.521 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -65.68 -50.51 53.66 Favored Glycine 0 C--N 1.335 0.483 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.877 179.583 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 11.5 tp -47.83 -51.59 22.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.367 0.603 . . . . 0.0 110.584 174.514 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.505 ' O ' ' HG3' ' A' ' 30' ' ' ARG . 12.8 tp10 -65.03 -40.25 94.56 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.77 -176.7 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.07 -41.76 98.5 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.046 0.451 . . . . 0.0 110.629 178.281 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 83.5 t80 -71.71 -45.57 61.4 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.152 -176.201 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.635 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 9.0 t -60.79 -45.27 95.05 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 120.937 -0.305 . . . . 0.0 110.399 -177.788 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.505 ' HG3' ' O ' ' A' ' 26' ' ' GLU . 73.8 mtt-85 -58.92 -40.48 84.67 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.017 0.437 . . . . 0.0 109.988 178.361 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.525 ' O ' HG22 ' A' ' 34' ' ' THR . 94.5 t80 -63.92 -30.88 71.93 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.479 177.549 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.482 HD23 HG22 ' A' ' 41' ' ' ILE . 18.9 tp -85.72 -20.11 29.82 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.464 -179.028 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.635 ' HG3' ' O ' ' A' ' 29' ' ' THR . 66.1 mttm -77.6 -36.14 52.11 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.018 178.951 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.525 HG22 ' O ' ' A' ' 31' ' ' PHE . 14.8 t -63.81 -29.96 71.1 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 120.884 0.373 . . . . 0.0 110.972 -177.919 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -91.99 2.77 56.34 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.412 177.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 89.9 m-85 55.96 47.22 20.41 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.318 179.176 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 20.3 t -131.17 15.17 5.14 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.466 176.188 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.428 ' HB2' ' OE1' ' A' ' 42' ' ' GLU . 0.1 OUTLIER -57.16 -24.25 53.06 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 115.172 -0.922 . . . . 0.0 111.199 -179.374 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.453 ' O ' ' HB2' ' A' ' 43' ' ' PHE . 11.4 pt-20 -40.13 -36.06 0.46 Allowed 'General case' 0 C--O 1.225 -0.236 0 CA-C-N 115.205 -0.907 . . . . 0.0 112.161 178.442 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.456 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 46.5 m-80 -66.95 -62.17 1.57 Allowed 'General case' 0 C--O 1.245 0.816 0 CA-C-O 121.07 0.462 . . . . 0.0 111.528 -176.833 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.521 HD13 ' HB ' ' A' ' 29' ' ' THR . 13.1 tt -62.43 -44.09 98.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.194 -176.608 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.428 ' OE1' ' HB2' ' A' ' 38' ' ' GLU . 0.9 OUTLIER -63.17 -31.5 72.66 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.071 177.365 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.456 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 76.3 t80 -55.93 -60.77 2.99 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 120.706 0.288 . . . . 0.0 110.828 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.51 ' HB2' ' HG3' ' A' ' 105' ' ' GLN . 28.6 p-90 -78.05 -11.16 59.89 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 119.722 -0.791 . . . . 0.0 111.929 -176.15 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.481 HG13 ' O ' ' A' ' 41' ' ' ILE . 54.2 mt -68.66 -39.68 80.68 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 168.2 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.55 -32.37 73.99 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.898 174.157 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.413 ' O ' ' HB3' ' A' ' 50' ' ' PHE . 43.4 t -66.54 -28.78 68.81 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.583 175.792 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.521 ' O ' ' HG3' ' A' ' 51' ' ' LYS . 4.3 tm-20 -72.81 -40.08 66.13 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 177.134 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -65.04 -33.75 76.79 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.821 174.575 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' PHE . . . . . 0.413 ' HB3' ' O ' ' A' ' 47' ' ' CYS . 74.0 t80 -60.67 -58.73 7.23 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.901 177.017 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.521 ' HG3' ' O ' ' A' ' 48' ' ' GLU . 0.0 OUTLIER -63.29 -20.75 65.76 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 116.615 -0.266 . . . . 0.0 111.491 -179.139 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -72.05 -26.81 62.33 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.893 0.378 . . . . 0.0 110.685 177.216 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 42.7 m -66.65 106.86 1.93 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.996 -177.124 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.24 -4.84 56.95 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.929 179.788 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -80.43 117.04 4.37 Favored Glycine 0 CA--C 1.52 0.373 0 N-CA-C 111.529 -0.628 . . . . 0.0 111.529 175.775 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -50.82 -46.53 29.86 Favored 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 122.921 2.414 . . . . 0.0 112.687 -177.191 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 7.3 pm0 -71.57 -33.2 68.89 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.037 0.446 . . . . 0.0 109.946 179.562 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -62.2 -36.62 82.47 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.981 -177.962 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.434 HG22 ' HG2' ' A' ' 96' ' ' PRO . 71.5 mt -53.89 -43.62 57.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.471 176.789 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 77.9 m80 -63.66 -43.88 95.43 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.192 178.784 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 53.6 mt -64.59 -49.37 71.4 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.138 -175.985 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -56.48 -50.87 70.5 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.205 179.151 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.97 -41.64 98.24 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.049 -179.686 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 50.5 tptt -59.53 -45.33 92.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.463 -179.534 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.18 -56.18 21.26 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.636 179.099 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 71.0 mt -57.67 -37.08 57.18 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.481 -179.461 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.457 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 86.1 t80 -58.38 -60.82 3.19 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.54 -179.446 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -82.87 -1.05 50.99 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.911 -171.936 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 57.5 tptt -105.82 -31.76 8.69 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.748 -0.206 . . . . 0.0 111.008 178.238 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 81.2 m-85 -130.01 -43.5 1.2 Allowed 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 -172.242 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.457 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 48.2 mm -77.93 -32.88 17.92 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 CA-C-O 121.046 0.451 . . . . 0.0 111.711 -173.477 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.546 ' HB3' ' HB2' ' A' ' 75' ' ' ALA . 7.0 tp60 -77.02 144.49 38.62 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.196 -173.824 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 89.4 m -71.64 -34.98 70.24 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.826 -178.37 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.407 ' H ' ' HG3' ' A' ' 72' ' ' GLN . 3.1 p30 -87.73 10.58 17.82 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 120.91 0.386 . . . . 0.0 110.747 177.21 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.546 ' HB2' ' HB3' ' A' ' 72' ' ' GLN . . . -69.91 154.11 94.93 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.528 179.15 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -55.18 -28.69 62.66 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.668 2.245 . . . . 0.0 112.25 178.536 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 17.9 tppt? -107.3 -69.51 0.84 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.488 -178.095 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 63.07 108.17 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.273 0.559 . . . . 0.0 110.023 -170.48 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 48.9 t -93.9 155.61 3.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.357 -176.515 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.486 ' HB2' HD21 ' A' ' 111' ' ' LEU . 45.0 m-80 -78.02 48.45 0.72 Allowed 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.238 0.542 . . . . 0.0 110.8 -179.746 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.416 HD11 HG21 ' A' ' 85' ' ' THR . 23.4 tp -79.45 151.7 30.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.382 179.291 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -53.88 137.53 38.54 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.827 -179.815 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 28.8 p90 -59.02 -45.75 89.94 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.438 -176.893 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 83.3 t60 -69.9 -30.83 68.36 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.764 0.316 . . . . 0.0 110.675 -176.662 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.416 HG21 HD11 ' A' ' 81' ' ' LEU . 39.3 m -64.8 -50.28 67.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.434 179.484 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.426 ' O ' HG23 ' A' ' 90' ' ' THR . 16.0 ptpt -71.66 -24.1 61.79 Favored 'General case' 0 CA--C 1.527 0.077 0 C-N-CA 120.76 -0.376 . . . . 0.0 110.713 -179.568 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -55.52 -53.88 50.83 Favored 'General case' 0 N--CA 1.462 0.161 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 173.512 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 53.1 t -56.77 -45.61 83.03 Favored 'Isoleucine or valine' 0 C--O 1.234 0.254 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.328 178.016 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 71.9 mt -59.4 -47.64 89.92 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.21 -178.527 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.426 HG23 ' O ' ' A' ' 86' ' ' LYS . 66.6 p -62.83 -27.06 69.06 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 120.867 0.365 . . . . 0.0 111.052 -178.173 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 82.3 m-20 -90.87 -14.2 32.21 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.459 -179.033 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 14.4 m -118.04 -0.01 11.74 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 111.804 0.298 . . . . 0.0 111.804 -176.071 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 7.8 tp -59.9 -23.26 26.19 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 CA-C-O 120.802 0.334 . . . . 0.0 111.337 -177.949 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' THR . . . . . 0.569 HG23 ' HG2' ' A' ' 95' ' ' GLN . 5.9 t -59.79 -32.71 70.86 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.855 178.749 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.569 ' HG2' HG23 ' A' ' 94' ' ' THR . 11.7 pt20 -165.05 93.02 0.92 Allowed Pre-proline 0 CA--C 1.533 0.32 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.051 177.443 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.434 ' HG2' HG22 ' A' ' 59' ' ' ILE . 94.2 Cg_endo -81.8 158.24 18.61 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.82 2.347 . . . . 0.0 112.594 -178.719 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 25.0 p -84.28 173.83 10.66 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.955 177.725 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' LEU . . . . . 0.488 ' H ' HD22 ' A' ' 98' ' ' LEU . 3.4 mm? -49.62 -43.77 46.85 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 123.208 0.603 . . . . 0.0 112.485 -172.87 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 -129.11 28.74 5.25 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.208 -173.588 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 6.3 p -46.09 -36.15 5.56 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 112.967 0.729 . . . . 0.0 112.967 -173.685 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -82.06 18.81 1.26 Allowed 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -177.84 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -70.64 -37.76 73.78 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 121.13 0.49 . . . . 0.0 109.899 179.028 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' ALA . . . . . 0.439 ' O ' ' HG2' ' A' ' 107' ' ' ARG . . . -61.72 -46.04 91.38 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.724 175.448 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.28 -40.99 96.16 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.493 178.278 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.51 ' HG3' ' HB2' ' A' ' 44' ' ' TRP . 26.2 tt0 -57.83 -45.82 85.63 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.621 177.663 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 18.5 m -63.27 -43.64 97.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.83 -179.797 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' ARG . . . . . 0.439 ' HG2' ' O ' ' A' ' 103' ' ' ALA . 20.5 mmt180 -58.14 -53.51 57.49 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.917 179.207 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.437 ' O ' ' SD ' ' A' ' 112' ' ' MET . 99.5 t -69.11 -35.9 70.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.457 -175.794 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 109' ' ' TYR . . . . . 0.41 ' HA ' ' HE1' ' A' ' 112' ' ' MET . 67.7 t80 -53.8 -54.55 36.72 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.031 0.444 . . . . 0.0 110.826 179.092 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 26.6 pt20 -73.85 -20.15 60.52 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.829 179.235 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.486 HD21 ' HB2' ' A' ' 80' ' ' ASN . 35.6 tp -61.58 -49.66 75.74 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.257 -176.814 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 112' ' ' MET . . . . . 0.505 ' HE3' ' HE1' ' A' ' 44' ' ' TRP . 0.0 OUTLIER -83.5 -29.63 27.81 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 120.312 -0.555 . . . . 0.0 110.263 177.529 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 113' ' ' GLU . . . . . 0.644 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 40.1 tt0 -52.36 -53.38 45.49 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 120.936 0.398 . . . . 0.0 110.721 179.188 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 114' ' ' GLN . . . . . 0.412 ' HG2' ' O ' ' A' ' 111' ' ' LEU . 29.8 pt20 -52.58 -18.95 1.98 Allowed 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 113.623 0.971 . . . . 0.0 113.623 -170.638 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 115' ' ' ASP . . . . . 0.583 ' O ' ' HG3' ' A' ' 119' ' ' ARG . 35.5 t70 -141.84 -52.86 0.43 Allowed 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 118.087 0.403 . . . . 0.0 111.68 -178.715 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 22.6 m -59.83 -31.76 70.03 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 120.665 0.269 . . . . 0.0 111.252 -178.801 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' TYR . . . . . 0.644 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 16.1 t80 -71.4 -42.75 67.94 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-O 120.647 0.261 . . . . 0.0 110.451 179.795 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 7.8 p -65.99 -35.54 80.87 Favored 'General case' 0 C--O 1.24 0.585 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.635 178.509 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' ARG . . . . . 0.583 ' HG3' ' O ' ' A' ' 115' ' ' ASP . 95.4 mtt180 -54.42 -51.13 65.9 Favored 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 172.266 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 79.6 t80 -58.39 -38.67 77.78 Favored 'General case' 0 C--O 1.225 -0.211 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.42 179.257 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 68.4 mt -62.95 -23.34 67.36 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.595 -179.272 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 2.4 tppp? -118.69 12.27 13.01 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.099 0.476 . . . . 0.0 111.311 177.981 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 95.2 p -71.17 146.81 48.88 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 176.245 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -56.48 -30.39 62.88 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 176.752 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 125' ' ' ILE . . . . . 0.424 ' O ' ' HG ' ' A' ' 129' ' ' LEU . 78.5 mt -56.94 -54.51 29.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-N 115.138 -0.937 . . . . 0.0 110.335 175.712 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 126' ' ' TYR . . . . . 0.482 ' O ' ' HG2' ' A' ' 130' ' ' MET . 75.7 t80 -64.1 -38.23 90.3 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.442 -178.888 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 92.4 mt -61.87 -36.1 80.25 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.166 177.535 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -70.6 -32.51 69.9 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.112 176.841 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 129' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' A' ' 125' ' ' ILE . 95.9 mt -72.29 -26.82 62.11 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.503 176.43 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 130' ' ' MET . . . . . 0.484 ' O ' ' HB2' ' A' ' 131' ' ' GLU . 27.2 mmt -67.44 -64.64 0.82 Allowed 'General case' 0 C--O 1.232 0.167 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 176.089 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 131' ' ' GLU . . . . . 0.484 ' HB2' ' O ' ' A' ' 130' ' ' MET . 1.6 tm-20 170.49 -73.41 0.0 OUTLIER 'General case' 0 C--O 1.233 0.196 0 N-CA-C 108.261 -1.015 . . . . 0.0 108.261 179.3 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 167.57 -54.56 0.23 Allowed Glycine 0 N--CA 1.45 -0.431 0 N-CA-C 110.802 -0.919 . . . . 0.0 110.802 -178.576 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 4.3 ptp85 -146.83 91.64 5.19 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 120.67 0.271 . . . . 0.0 110.965 177.274 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo . . . . . 0 C--N 1.349 0.554 0 C-N-CA 122.382 2.055 . . . . 0.0 110.817 172.962 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 7.2 m . . . . . 0 N--CA 1.477 0.898 0 CA-C-O 120.749 0.309 . . . . 0.0 110.563 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 27.3 ttt -148.74 104.19 3.45 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 179.259 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' VAL . . . . . 0.49 HG21 ' CH2' ' A' ' 11' ' ' TRP . 2.6 p -125.65 146.09 31.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.973 -178.042 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 34.4 m -114.6 155.75 45.65 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.645 177.117 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 80.5 Cg_exo -49.25 -37.11 39.05 Favored 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 122.91 2.407 . . . . 0.0 112.742 -178.401 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.448 ' O ' HG22 ' A' ' 9' ' ' VAL . 5.3 mp0 -64.62 -36.32 83.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.857 179.333 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.456 ' HB3' HG23 ' A' ' 3' ' ' VAL . 25.8 tp10 -68.37 -36.03 78.6 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 175.765 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.93 -41.38 91.43 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.338 179.922 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.448 HG22 ' O ' ' A' ' 6' ' ' GLU . 19.4 m -70.55 -23.24 24.19 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 CA-C-O 120.895 0.378 . . . . 0.0 110.29 178.717 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.48 ' O ' ' HD2' ' A' ' 17' ' ' LYS . 67.4 mmtt -67.13 -39.34 86.61 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-O 121.077 0.465 . . . . 0.0 109.847 171.68 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' TRP . . . . . 0.49 ' CH2' HG21 ' A' ' 3' ' ' VAL . 47.1 m0 -62.74 -27.09 69.04 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 175.075 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -72.42 -31.77 62.96 Favored Glycine 0 CA--C 1.52 0.358 0 CA-C-N 115.392 -0.822 . . . . 0.0 112.911 178.921 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' A' ' 10' ' ' LYS . 11.5 pt-20 -82.56 -23.11 34.65 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 117.147 0.474 . . . . 0.0 111.162 -178.941 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.522 ' HB2' ' HG2' ' A' ' 17' ' ' LYS . 49.8 m -152.22 107.68 3.3 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -179.619 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' PHE . . . . . 0.474 ' CD1' HD23 ' A' ' 18' ' ' LEU . 40.2 t80 -53.65 -27.42 27.3 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.55 175.49 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -59.2 -54.11 50.61 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.328 177.43 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.522 ' HG2' ' HB2' ' A' ' 14' ' ' SER . 17.7 ptpt -71.56 -20.08 62.07 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 120.937 -0.305 . . . . 0.0 110.599 -175.121 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.476 ' O ' ' HA3' ' A' ' 24' ' ' GLY . 48.9 tp -59.01 -48.95 79.75 Favored 'General case' 0 N--CA 1.463 0.183 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 169.656 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.503 HD23 ' CZ2' ' A' ' 44' ' ' TRP . 0.8 OUTLIER -77.44 -27.52 52.22 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.948 -179.539 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.5 ' HB3' ' HA ' ' A' ' 17' ' ' LYS . 9.7 t -74.61 -25.08 59.01 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.508 -178.125 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -92.15 126.79 37.38 Favored 'General case' 0 C--O 1.232 0.179 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 177.784 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 36.2 ttm180 -51.6 -39.71 58.49 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 120.739 0.304 . . . . 0.0 110.569 179.355 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -61.73 -40.55 95.47 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.051 179.212 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.476 ' HA3' ' O ' ' A' ' 18' ' ' LEU . . . -68.11 -48.94 50.43 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.855 -0.688 . . . . 0.0 111.517 -179.416 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 7.8 tt -58.23 -38.66 77.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.025 0.441 . . . . 0.0 110.07 174.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -61.22 -51.71 67.82 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.379 179.234 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -68.73 -32.95 73.1 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.916 179.468 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -73.73 -37.59 65.05 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.951 -176.284 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.457 ' O ' ' HB2' ' A' ' 33' ' ' LYS . 11.2 t -71.23 -44.39 65.43 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 121.027 -0.269 . . . . 0.0 110.58 -178.816 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 11.8 ptm180 -64.71 -32.73 74.53 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 120.847 0.356 . . . . 0.0 110.39 178.842 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 85.7 t80 -70.29 -55.73 8.48 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.205 177.338 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.443 HD23 ' HA ' ' A' ' 38' ' ' GLU . 25.5 tp -67.02 -16.5 64.4 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.996 -176.877 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.457 ' HB2' ' O ' ' A' ' 29' ' ' THR . 22.3 ttmm -69.6 -18.82 63.65 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.699 178.944 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 13.9 t -56.61 -26.32 55.35 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.038 0.447 . . . . 0.0 111.215 -179.145 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -124.59 8.12 8.28 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.39 179.376 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 53.37 41.22 32.14 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.583 176.761 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 50.5 m -107.49 20.51 18.8 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.937 179.551 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.443 ' HA ' HD23 ' A' ' 32' ' ' LEU . 6.6 pt-20 -69.3 -6.94 32.73 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.035 178.684 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -42.73 -38.4 2.07 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.049 171.113 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.529 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 50.0 m-80 -64.75 -57.83 7.89 Favored 'General case' 0 C--O 1.245 0.831 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.568 -176.117 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.432 ' O ' HG13 ' A' ' 45' ' ' ILE . 9.8 tt -60.9 -41.05 87.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.13 -0.486 . . . . 0.0 109.822 -177.85 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.529 ' HA ' ' HB ' ' A' ' 45' ' ' ILE . 53.7 mt-10 -67.14 -30.14 70.05 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.859 178.213 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.529 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 81.4 t80 -54.49 -60.71 2.99 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.559 179.16 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' TRP . . . . . 0.626 ' HA ' ' SG ' ' A' ' 47' ' ' CYS . 26.4 p-90 -79.8 -14.51 58.64 Favored 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 119.357 -0.937 . . . . 0.0 111.614 -178.645 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.529 ' HB ' ' HA ' ' A' ' 42' ' ' GLU . 18.4 mt -62.99 -38.72 82.75 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 168.612 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.93 -36.27 82.91 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.872 174.226 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.626 ' SG ' ' HA ' ' A' ' 44' ' ' TRP . 64.3 m -61.51 -31.08 71.06 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.726 176.566 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.501 ' HG2' ' O ' ' A' ' 44' ' ' TRP . 9.2 mm-40 -73.82 -38.21 64.62 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 120.968 0.413 . . . . 0.0 109.899 176.398 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -57.74 -35.95 71.4 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.409 0.623 . . . . 0.0 109.9 174.446 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 51.0 t80 -72.46 -45.28 60.23 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 114.862 -1.063 . . . . 0.0 110.398 174.371 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.464 ' HB3' ' HA ' ' A' ' 48' ' ' GLU . 4.1 tmtm? -54.73 -38.27 66.92 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.635 -0.711 . . . . 0.0 112.502 -176.631 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 22.9 pttm -72.74 -21.19 61.06 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.043 0.449 . . . . 0.0 110.792 -176.318 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 22.7 m -81.46 75.79 8.41 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.187 -177.427 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.88 -5.99 42.03 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.943 -176.07 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -73.65 125.96 9.55 Favored Glycine 0 CA--C 1.521 0.414 0 C-N-CA 121.142 -0.552 . . . . 0.0 112.258 177.986 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_exo -48.0 -46.53 21.75 Favored 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 123.037 2.491 . . . . 0.0 112.84 -177.201 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -63.12 -42.3 99.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.625 -179.325 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -64.08 -36.7 84.88 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.578 -177.515 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 30.6 mm -51.96 -55.92 7.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.298 179.111 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 71.8 m80 -62.89 -38.76 92.18 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.947 -175.701 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 88.6 mt -69.16 -55.16 11.49 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.012 -178.069 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.478 ' HA ' ' HE2' ' A' ' 62' ' ' LYS . 7.4 mmpt? -59.83 -40.09 87.31 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.013 -178.201 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.12 -46.86 84.85 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.771 178.81 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 4.2 tppp? -66.04 -32.2 73.54 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.79 -179.63 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.03 -59.16 5.49 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 120.945 0.403 . . . . 0.0 110.25 177.565 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 65.5 mt -59.52 -35.19 57.62 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.331 178.315 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.403 ' CE1' HG22 ' A' ' 90' ' ' THR . 77.2 t80 -54.17 -63.22 1.22 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.944 -179.713 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -79.35 -9.6 59.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 0.0 112.185 -172.787 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 56.1 tptt -98.02 -33.34 11.22 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 111.627 0.232 . . . . 0.0 111.627 -179.743 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 69.9 m-85 -128.05 -43.86 1.48 Allowed 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -173.34 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 49.6 mm -67.82 -40.49 83.75 Favored 'Isoleucine or valine' 0 C--O 1.238 0.468 0 CA-C-O 120.912 0.387 . . . . 0.0 111.185 -173.853 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' GLN . . . . . 0.596 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . 15.8 mm100 -60.59 141.53 56.55 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.541 178.119 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 92.4 m -67.13 -53.25 32.36 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.543 -179.477 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -88.95 27.9 1.27 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.631 -179.506 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.596 ' HB2' ' HB2' ' A' ' 72' ' ' GLN . . . -62.28 160.04 35.27 Favored Pre-proline 0 CA--C 1.531 0.247 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.0 178.358 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -72.19 48.05 1.14 Allowed 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 123.136 2.557 . . . . 0.0 112.48 176.249 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -178.92 -59.0 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 178.07 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 69.86 126.48 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.756 -177.439 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 57.8 t -121.04 138.2 52.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.422 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.935 177.189 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 37.1 m-80 -75.08 86.05 2.35 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.509 0.671 . . . . 0.0 111.075 179.567 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 15.1 tp -125.58 151.92 45.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.102 -0.953 . . . . 0.0 109.974 178.395 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -57.49 135.37 56.61 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.397 179.293 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 81.6 m-85 -67.68 -42.65 81.75 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.06 -175.982 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 72.7 t60 -58.62 -31.89 68.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.965 0.412 . . . . 0.0 110.381 178.285 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 37.7 m -66.97 -46.54 74.32 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.741 178.346 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -69.68 -24.99 63.67 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.226 -179.419 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -59.24 -52.41 65.79 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.392 0.615 . . . . 0.0 109.892 174.504 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 91.6 t -59.52 -39.28 78.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.027 177.931 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 81.5 mt -63.41 -43.8 98.65 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.04 179.107 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.403 HG22 ' CE1' ' A' ' 67' ' ' TYR . 33.7 p -65.09 -23.68 67.23 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-O 120.828 0.347 . . . . 0.0 111.097 -178.965 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 39.2 m-80 -86.92 -21.76 26.09 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.897 176.065 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 28.2 t -99.35 -9.49 23.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.29 -177.345 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.4 tp -58.16 -26.29 29.03 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 CA-C-O 120.783 0.325 . . . . 0.0 111.665 -175.771 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 6.0 t -62.95 -44.59 95.66 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.103 -179.835 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -148.62 79.9 8.52 Favored Pre-proline 0 N--CA 1.464 0.225 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 179.853 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -84.73 155.11 11.76 Favored 'Trans proline' 0 N--CA 1.46 -0.454 0 C-N-CA 122.579 2.186 . . . . 0.0 112.104 179.164 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 25.2 p -89.63 169.67 11.12 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.387 175.675 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 9.0 mp -53.28 -27.79 24.57 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 122.818 0.447 . . . . 0.0 112.043 -175.396 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' HIS . . . . . 0.463 ' HD2' ' HB2' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -131.02 44.01 3.02 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.101 0.477 . . . . 0.0 110.118 177.224 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 34.7 t -57.49 -34.47 69.08 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.471 176.68 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 85.7 m-85 -81.88 14.68 2.59 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.367 -178.322 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' ASP . . . . . 0.414 ' HB2' ' O ' ' A' ' 99' ' ' HIS . 12.8 t70 -57.83 -44.2 86.32 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 120.831 0.348 . . . . 0.0 110.537 -178.725 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.34 -43.05 96.82 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 121.06 0.457 . . . . 0.0 110.751 177.511 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.68 -37.85 88.92 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.168 178.888 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.611 HE21 ' HB2' ' A' ' 44' ' ' TRP . 34.3 tt0 -63.7 -45.05 91.74 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.137 178.232 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 36.5 m -57.74 -47.19 83.17 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.358 177.611 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 23.0 mmt180 -52.71 -62.66 1.51 Allowed 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.947 178.297 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' VAL . . . . . 0.436 HG13 ' HB3' ' A' ' 40' ' ' ASN . 80.8 t -60.23 -42.6 90.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.449 -176.118 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 49.9 t80 -56.44 -51.88 66.74 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.095 -178.246 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 5.2 pp0? -73.45 -23.9 60.16 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 116.785 -0.189 . . . . 0.0 111.427 -176.87 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 61.7 mt -67.61 -49.14 64.5 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.82 0.343 . . . . 0.0 110.235 175.637 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 49.7 mtm -64.34 -36.48 84.27 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 116.158 -0.474 . . . . 0.0 109.886 178.061 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' GLU . . . . . 0.595 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 44.7 tt0 -55.74 -65.69 0.55 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.631 179.64 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -62.0 -15.64 45.64 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 113.034 0.753 . . . . 0.0 113.034 -171.938 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -121.84 -61.95 1.45 Allowed 'General case' 0 N--CA 1.466 0.33 0 O-C-N 121.979 -0.45 . . . . 0.0 112.059 -176.002 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 2.6 m -68.74 -39.09 80.5 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.886 -177.018 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 117' ' ' TYR . . . . . 0.595 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 36.1 t80 -78.24 -37.81 44.42 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.986 -173.831 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 21.1 p -61.05 -48.94 79.4 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.219 0.533 . . . . 0.0 110.111 176.342 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 65.5 mtm180 -64.62 -34.33 78.02 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.39 176.236 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -61.27 -37.6 83.75 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.623 177.692 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.416 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 95.4 mt -63.66 -44.93 92.34 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.203 0.525 . . . . 0.0 110.606 177.546 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 23.0 tptp -92.13 5.02 51.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.696 -174.016 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 85.3 p -69.09 141.19 54.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.786 0.327 . . . . 0.0 110.918 178.84 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -56.07 -32.7 64.34 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.042 177.202 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -65.76 -36.86 78.58 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.237 179.592 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -74.44 -38.0 63.12 Favored 'General case' 0 C--O 1.233 0.192 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 177.059 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 95.8 mt -61.75 -28.43 69.43 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.972 175.836 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -69.4 -41.7 76.08 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.086 173.585 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 98.1 mt -63.41 -25.68 68.39 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.569 178.302 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 130' ' ' MET . . . . . . . . . . . . . 28.8 mmt -77.64 -54.41 6.42 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.247 175.249 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 54.32 37.37 27.33 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 121.868 0.842 . . . . 0.0 109.677 -178.289 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 102.1 -66.29 0.42 Allowed Glycine 0 N--CA 1.45 -0.388 0 N-CA-C 110.681 -0.968 . . . . 0.0 110.681 -174.468 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 133' ' ' ARG . . . . . 0.543 ' HD2' ' O ' ' A' ' 134' ' ' PRO . 6.8 tmm_? 60.99 111.94 0.02 OUTLIER Pre-proline 0 CA--C 1.539 0.557 0 C-N-CA 123.399 0.68 . . . . 0.0 111.369 174.879 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 134' ' ' PRO . . . . . 0.543 ' O ' ' HD2' ' A' ' 133' ' ' ARG . 75.3 Cg_exo . . . . . 0 C--N 1.354 0.863 0 C-N-CA 123.035 2.49 . . . . 0.0 112.862 179.738 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 2.9 p . . . . . 0 C--O 1.233 0.228 0 CA-C-O 120.823 0.344 . . . . 0.0 110.275 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.1 m -96.19 149.89 36.49 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.046 178.05 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -51.0 -35.54 50.65 Favored 'Trans proline' 0 C--N 1.352 0.715 0 C-N-CA 122.88 2.387 . . . . 0.0 112.364 -179.178 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.53 ' O ' HG22 ' A' ' 9' ' ' VAL . 34.4 tt0 -59.78 -52.0 67.35 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.06 0.457 . . . . 0.0 110.408 176.678 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 32.8 tp10 -56.49 -39.22 72.91 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.641 177.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.96 -46.02 86.5 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 115.758 -0.656 . . . . 0.0 111.731 -179.075 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.53 HG22 ' O ' ' A' ' 6' ' ' GLU . 24.7 m -67.16 -28.32 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 CA-C-O 120.931 0.396 . . . . 0.0 110.229 -179.862 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -70.7 -32.05 69.13 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.227 175.725 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 53.2 m0 -66.4 -21.88 66.23 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 173.747 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -83.17 2.15 87.48 Favored Glycine 0 C--N 1.335 0.495 0 CA-C-N 115.707 -0.678 . . . . 0.0 112.915 -179.45 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -125.51 -41.33 2.02 Favored 'General case' 0 C--O 1.234 0.274 0 O-C-N 122.803 -0.234 . . . . 0.0 110.532 176.588 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.435 ' HB2' ' HB3' ' A' ' 17' ' ' LYS . 14.0 m -108.74 101.92 11.01 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 120.842 0.353 . . . . 0.0 110.983 -178.758 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -61.95 -39.7 93.02 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.459 -178.612 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -64.7 -31.63 72.94 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.525 178.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.435 ' HB3' ' HB2' ' A' ' 14' ' ' SER . 62.5 tttp -70.5 -35.07 73.01 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 179.633 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.4 tp -62.15 -48.0 82.03 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.025 173.568 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.408 ' O ' ' HB2' ' A' ' 25' ' ' LEU . 60.2 tp -65.93 -49.07 69.26 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.624 -177.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 44.1 m -67.33 -29.43 69.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.788 -173.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -76.67 119.78 20.95 Favored 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 179.539 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -51.61 -39.19 57.54 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 121.088 0.471 . . . . 0.0 110.632 -176.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -66.78 -38.33 86.33 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.12 -179.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -71.95 -50.17 19.44 Favored Glycine 0 C--N 1.333 0.382 0 CA-C-N 115.505 -0.77 . . . . 0.0 111.955 -178.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.408 ' HB2' ' O ' ' A' ' 19' ' ' LEU . 7.9 tt -52.0 -43.16 63.52 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 122.787 0.435 . . . . 0.0 110.112 175.501 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.495 ' O ' ' HG3' ' A' ' 30' ' ' ARG . 13.6 tp10 -58.12 -56.07 26.79 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.466 178.179 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -60.76 -40.78 93.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.333 -177.281 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 62.8 t80 -69.71 -43.6 72.05 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.785 -175.004 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.422 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 11.6 t -67.9 -41.21 83.04 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 121.075 -0.25 . . . . 0.0 110.732 -178.466 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.495 ' HG3' ' O ' ' A' ' 26' ' ' GLU . 58.7 mtp180 -62.16 -43.22 99.33 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.974 0.416 . . . . 0.0 110.235 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.585 ' O ' HG22 ' A' ' 34' ' ' THR . 87.0 t80 -64.45 -47.13 80.22 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.978 175.816 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.459 HD23 ' HA ' ' A' ' 38' ' ' GLU . 12.2 tp -64.95 -21.83 66.9 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.86 -175.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.422 ' HG3' ' O ' ' A' ' 29' ' ' THR . 38.8 mttp -68.06 -29.98 69.08 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.713 178.591 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.585 HG22 ' O ' ' A' ' 31' ' ' PHE . 3.6 t -65.7 -21.93 66.58 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 120.871 0.367 . . . . 0.0 110.647 -177.208 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -118.56 7.44 11.8 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.819 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 56.2 t80 58.24 19.17 5.97 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.864 175.051 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 42.2 m -79.27 0.7 27.65 Favored 'General case' 0 C--N 1.327 -0.384 0 O-C-N 121.985 -0.447 . . . . 0.0 110.636 -178.216 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.47 ' HA ' HG22 ' A' ' 41' ' ' ILE . 7.5 pt-20 -59.26 -22.88 61.8 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.61 176.661 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -53.21 -45.98 68.85 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.665 176.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.521 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 91.7 m-20 -64.4 -52.19 59.42 Favored 'General case' 0 C--O 1.241 0.654 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.633 -177.255 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.47 HG22 ' HA ' ' A' ' 38' ' ' GLU . 13.0 tt -61.46 -44.7 99.01 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.155 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.369 -177.259 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.51 ' HA ' ' HB ' ' A' ' 45' ' ' ILE . 40.9 mt-10 -73.26 -21.19 60.66 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.101 -179.779 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.521 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 37.1 t80 -58.16 -60.5 3.66 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 120.614 0.245 . . . . 0.0 110.34 175.27 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.576 ' HB2' ' HG2' ' A' ' 105' ' ' GLN . 47.1 p-90 -75.77 -18.78 59.41 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 119.893 -0.723 . . . . 0.0 111.35 -177.667 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.51 ' HB ' ' HA ' ' A' ' 42' ' ' GLU . 41.4 mt -63.62 -41.51 92.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 169.656 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.07 -31.25 72.02 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.216 175.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.496 ' SG ' ' HA ' ' A' ' 44' ' ' TRP . 74.5 m -67.61 -32.73 73.66 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.433 176.812 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 55.0 mm-40 -71.52 -37.02 71.24 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 116.595 -0.275 . . . . 0.0 110.419 175.051 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -65.57 -36.74 84.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.422 0.629 . . . . 0.0 109.406 176.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.408 ' CZ ' HG23 ' A' ' 59' ' ' ILE . 50.4 t80 -62.67 -47.05 85.36 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 114.977 -1.01 . . . . 0.0 109.951 172.612 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.97 -22.72 65.88 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 115.386 -0.824 . . . . 0.0 111.163 178.405 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.433 ' HE2' ' HB3' ' A' ' 52' ' ' LYS . 32.4 ttpt -76.8 -18.45 58.41 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.916 -0.583 . . . . 0.0 111.032 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 22.6 t -66.39 159.51 26.78 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 121.11 0.481 . . . . 0.0 111.159 -176.111 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.3 15.95 2.59 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.743 179.089 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -104.13 105.77 2.66 Favored Glycine 0 CA--C 1.518 0.271 0 N-CA-C 111.096 -0.802 . . . . 0.0 111.096 177.022 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -48.58 -50.49 12.27 Favored 'Trans proline' 0 C--N 1.35 0.613 0 C-N-CA 123.017 2.478 . . . . 0.0 112.863 -176.004 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 3.6 pp0? -65.89 -34.52 78.32 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.77 0.319 . . . . 0.0 110.888 177.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -68.07 -30.22 69.36 Favored 'General case' 0 N--CA 1.461 0.112 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.934 -179.124 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.408 HG23 ' CZ ' ' A' ' 50' ' ' PHE . 40.8 mm -56.88 -43.56 80.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.199 176.424 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 21.6 m-70 -69.65 -42.05 74.74 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.568 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 85.9 mt -64.01 -44.55 92.26 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.802 -179.68 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -66.79 -46.81 74.1 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.552 179.001 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.62 -40.24 91.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.223 -178.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 38.2 mmtm -65.72 -37.51 86.61 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.739 178.38 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.8 -53.95 46.41 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.089 0.471 . . . . 0.0 109.963 176.117 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.419 ' HA ' ' HD1' ' A' ' 70' ' ' PHE . 69.9 mt -59.6 -35.05 57.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.366 178.778 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.495 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 40.1 t80 -57.92 -68.13 0.27 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.215 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -67.56 -33.74 75.65 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.446 -173.375 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.488 ' HA ' ' HD2' ' A' ' 76' ' ' PRO . 88.1 tttt -86.58 -29.13 22.85 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.958 -0.565 . . . . 0.0 112.098 -172.544 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . 0.419 ' HD1' ' HA ' ' A' ' 66' ' ' ILE . 96.1 m-85 -125.03 -53.4 1.64 Allowed 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -174.556 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.495 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 42.4 mm -64.28 -34.39 68.79 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -169.28 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.431 ' HA ' ' OE1' ' A' ' 72' ' ' GLN . 14.1 mm-40 -58.27 155.86 10.86 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.469 0.652 . . . . 0.0 111.968 -177.513 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.8 t -74.59 -28.65 61.01 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.009 179.233 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -87.51 -82.66 0.22 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.209 175.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . 57.19 158.66 0.08 OUTLIER Pre-proline 0 CA--C 1.542 0.636 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 174.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.488 ' HD2' ' HA ' ' A' ' 69' ' ' LYS . 64.2 Cg_endo -75.25 -16.34 19.72 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.31 2.006 . . . . 0.0 111.602 170.871 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -105.61 -51.81 2.93 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.418 177.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 64.51 93.59 0.06 Allowed 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.299 -175.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 65.5 t -86.29 141.92 13.79 Favored 'Isoleucine or valine' 0 C--O 1.237 0.443 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.759 -178.521 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 36.4 m-80 -78.14 23.41 0.28 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.42 -176.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 18.0 tp -65.57 142.81 57.97 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.964 177.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -48.57 140.11 8.52 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.64 -0.709 . . . . 0.0 112.067 -179.087 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.404 ' O ' ' HG2' ' A' ' 86' ' ' LYS . 84.3 t80 -61.1 -52.89 62.98 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.387 -176.171 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 57.3 t60 -59.43 -38.59 81.08 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.869 0.366 . . . . 0.0 110.641 -177.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.431 ' O ' HG13 ' A' ' 89' ' ' ILE . 41.0 m -66.25 -51.62 55.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.76 -179.372 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.558 ' O ' HG23 ' A' ' 90' ' ' THR . 18.1 ptmt -67.29 -25.61 66.13 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.594 -177.64 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -64.08 -52.45 59.25 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-O 121.479 0.657 . . . . 0.0 109.405 175.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 99.0 t -58.95 -37.01 64.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.306 177.24 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.431 HG13 ' O ' ' A' ' 85' ' ' THR . 72.8 mt -66.98 -45.04 88.05 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.222 179.365 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.558 HG23 ' O ' ' A' ' 86' ' ' LYS . 48.4 p -57.34 -26.12 60.47 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 120.987 0.423 . . . . 0.0 110.757 -178.712 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -87.8 -41.42 13.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.148 175.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 22.5 t -79.51 -0.92 35.3 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.615 -174.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.9 tp -74.57 -4.53 5.78 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 CA-C-O 120.848 0.356 . . . . 0.0 111.552 -177.294 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 4.5 t -65.11 -47.18 78.08 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 116.686 -0.234 . . . . 0.0 110.881 179.048 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -132.23 81.35 61.41 Favored Pre-proline 0 N--CA 1.466 0.369 0 CA-C-O 121.161 0.505 . . . . 0.0 110.341 175.676 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_endo -71.43 139.62 35.01 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.746 2.298 . . . . 0.0 112.734 -176.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.441 ' H ' ' HB3' ' A' ' 100' ' ' SER . 35.4 p -87.18 172.93 9.55 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.419 173.509 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 41.7 tp -57.79 -36.61 72.42 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 121.189 0.519 . . . . 0.0 110.778 -179.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' HIS . . . . . 0.523 ' HB3' ' HB3' ' A' ' 102' ' ' ASP . 33.8 m-70 -113.28 38.87 2.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.12 177.174 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . 0.441 ' HB3' ' H ' ' A' ' 97' ' ' THR . 9.2 p -55.39 -38.78 69.34 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.053 0.454 . . . . 0.0 111.422 -179.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 -93.95 21.84 6.29 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.409 -177.342 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . 0.523 ' HB3' ' HB3' ' A' ' 99' ' ' HIS . 7.3 p-10 -63.99 -35.29 80.2 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 120.976 0.417 . . . . 0.0 110.192 -179.451 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.494 ' O ' ' HG2' ' A' ' 107' ' ' ARG . . . -63.42 -48.47 77.66 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.887 174.795 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -58.33 -43.1 88.07 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.505 179.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.576 ' HG2' ' HB2' ' A' ' 44' ' ' TRP . 0.9 OUTLIER -57.06 -53.16 61.27 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.778 178.397 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 47.4 m -58.47 -48.17 81.64 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.165 -178.793 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . 0.494 ' HG2' ' O ' ' A' ' 103' ' ' ALA . 29.9 mmt180 -56.64 -65.05 0.68 Allowed 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.958 0.409 . . . . 0.0 110.886 -178.578 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.421 ' O ' ' HG3' ' A' ' 112' ' ' MET . 63.5 t -58.46 -38.57 70.92 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.4 -174.184 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 86.8 t80 -56.52 -56.6 19.22 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.77 179.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 1.1 pp0? -75.29 -12.89 60.37 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.629 -0.259 . . . . 0.0 111.237 -177.375 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 107' ' ' ARG . 53.4 mt -72.8 -45.56 57.88 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 173.266 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . 0.421 ' HG3' ' O ' ' A' ' 108' ' ' VAL . 33.6 mtm -61.96 -34.81 76.81 Favored 'General case' 0 CA--C 1.52 -0.191 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 178.428 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . 0.564 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 3.9 tm-20 -56.81 -68.76 0.19 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.178 177.544 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -63.75 -19.43 64.95 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.866 -0.607 . . . . 0.0 112.305 -174.127 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -101.14 -71.33 0.71 Allowed 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 120.991 0.424 . . . . 0.0 111.523 -179.049 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 7.4 m -79.4 -33.54 42.64 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.068 -0.515 . . . . 0.0 112.136 -171.335 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . 0.564 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 41.4 t80 -75.24 -30.9 60.65 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.662 0.268 . . . . 0.0 110.773 -173.235 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 32.8 p -64.16 -56.21 16.38 Favored 'General case' 0 C--O 1.24 0.598 0 CA-C-O 120.991 0.424 . . . . 0.0 110.642 177.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 9.4 ptp85 -60.81 -32.48 71.84 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.021 177.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -60.77 -40.29 91.98 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.538 177.562 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 92.5 mt -71.62 -26.92 62.77 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.746 -178.318 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 16.4 tppt? -106.75 7.05 30.18 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 120.966 0.413 . . . . 0.0 111.342 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 86.9 p -74.8 156.61 36.33 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 110.249 -0.278 . . . . 0.0 110.249 178.454 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -58.74 -24.67 62.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.164 175.064 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 50.8 mm -61.92 -56.53 17.12 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.576 178.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 66.3 t80 -72.34 -37.75 68.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.548 -177.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 80.8 mt -63.81 -30.16 71.28 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.299 177.653 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -66.65 -38.73 87.48 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.091 174.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 98.8 mt -66.03 -28.59 68.98 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.301 176.069 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' MET . . . . . . . . . . . . . 26.6 mmt . . . . . 0 C--O 1.234 0.243 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.732 179.187 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 13.3 p . . . . . 0 C--O 1.235 0.29 0 CA-C-O 120.79 0.329 . . . . 0.0 110.35 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.7 m -66.11 135.62 95.16 Favored Pre-proline 0 CA--C 1.535 0.387 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.261 175.391 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -49.01 -29.58 16.01 Favored 'Trans proline' 0 C--N 1.354 0.864 0 C-N-CA 123.038 2.492 . . . . 0.0 112.281 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -52.61 -59.96 3.83 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.748 177.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.54 ' HA ' ' HB3' ' A' ' 10' ' ' LYS . 25.5 tt0 -79.82 -22.67 42.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.823 -177.614 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -56.9 -46.49 81.9 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 120.87 0.367 . . . . 0.0 110.304 176.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 33.7 m -76.16 -29.04 19.01 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.382 177.119 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.54 ' HB3' ' HA ' ' A' ' 7' ' ' GLU . 16.2 tppt? -65.08 -27.51 68.82 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.808 176.606 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 43.6 m0 -65.96 -27.52 68.22 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 120.682 0.277 . . . . 0.0 110.615 175.477 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -61.6 -12.55 34.23 Favored Glycine 0 CA--C 1.52 0.371 0 CA-C-N 115.728 -0.669 . . . . 0.0 114.209 -173.047 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.486 ' HG2' ' O ' ' A' ' 10' ' ' LYS . 12.0 pt-20 -104.36 -14.85 15.61 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 117.367 0.583 . . . . 0.0 111.901 -178.605 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.549 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 19.3 m -145.21 95.03 2.61 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-O 120.987 0.423 . . . . 0.0 111.901 -173.339 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.463 ' O ' ' HB3' ' A' ' 18' ' ' LEU . 15.9 t80 -54.86 -32.24 60.53 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.377 0.608 . . . . 0.0 109.884 175.122 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -57.15 -50.37 73.04 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.425 176.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.549 ' HG2' ' O ' ' A' ' 14' ' ' SER . 13.0 ptmm? -69.99 -22.86 63.09 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 120.81 -0.356 . . . . 0.0 110.081 -175.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.463 ' HB3' ' O ' ' A' ' 15' ' ' PHE . 62.8 tp -59.55 -54.7 43.47 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.917 174.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -68.44 -34.72 76.49 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.655 177.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.458 ' HB3' ' HA ' ' A' ' 17' ' ' LYS . 23.9 t -64.43 -25.09 67.86 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.508 179.376 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 16.2 t-80 -88.84 113.66 24.63 Favored 'General case' 0 C--O 1.223 -0.29 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 177.565 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 8.4 ptm180 -47.23 -45.27 23.38 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-O 120.782 0.325 . . . . 0.0 111.601 -176.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -67.59 -34.46 77.06 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.068 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -72.37 -41.67 51.67 Favored Glycine 0 C--N 1.331 0.282 0 N-CA-C 111.396 -0.682 . . . . 0.0 111.396 -179.194 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 7.3 tt -60.0 -41.85 93.0 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 174.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.457 ' O ' HG22 ' A' ' 29' ' ' THR . 30.2 tt0 -60.3 -55.5 32.95 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.77 176.676 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -56.75 -43.85 81.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.332 -178.301 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 80.2 t80 -68.45 -43.33 77.3 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.06 -176.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.457 HG22 ' O ' ' A' ' 26' ' ' GLU . 12.5 t -67.04 -35.7 80.47 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 120.665 -0.414 . . . . 0.0 110.083 -179.439 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.453 ' HG3' ' O ' ' A' ' 26' ' ' GLU . 43.4 mtp180 -64.74 -45.46 86.38 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 121.085 0.469 . . . . 0.0 109.753 176.23 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 80.1 t80 -62.43 -42.04 99.17 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.565 177.316 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.437 ' HA ' ' HB3' ' A' ' 35' ' ' GLU . 16.2 tp -75.42 -22.09 57.66 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.501 -176.438 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.531 ' HE2' ' HG3' ' A' ' 38' ' ' GLU . 1.5 mptm? -71.68 -47.26 55.36 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.013 174.31 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 14.5 t -73.46 -18.3 61.14 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 120.854 0.359 . . . . 0.0 110.085 177.538 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.437 ' HB3' ' HA ' ' A' ' 32' ' ' LEU . 10.2 tp10 -75.11 -25.05 58.2 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.318 171.445 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 33.9 t80 68.39 33.57 4.09 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.128 177.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.1 m -136.43 30.46 2.92 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.553 -178.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.531 ' HG3' ' HE2' ' A' ' 33' ' ' LYS . 0.1 OUTLIER -70.52 -11.49 60.96 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.009 -0.542 . . . . 0.0 111.193 -177.91 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -45.25 -37.32 4.58 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.275 176.372 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.621 HD21 ' HB2' ' A' ' 80' ' ' ASN . 4.4 m-20 -69.36 -50.54 45.26 Favored 'General case' 0 C--O 1.242 0.662 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.896 -178.671 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.471 HG22 ' O ' ' A' ' 38' ' ' GLU . 11.2 tt -64.83 -42.92 96.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 C-N-CA 121.021 -0.272 . . . . 0.0 110.281 -175.215 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.42 ' HA ' ' HB ' ' A' ' 45' ' ' ILE . 51.8 mt-10 -69.22 -25.36 64.27 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.433 -0.348 . . . . 0.0 110.482 178.783 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.502 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 78.1 t80 -57.54 -60.9 2.96 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.726 178.38 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.731 ' HA ' ' SG ' ' A' ' 47' ' ' CYS . 43.1 p-90 -78.78 -17.01 56.44 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 119.779 -0.769 . . . . 0.0 111.82 -178.336 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.42 ' HB ' ' HA ' ' A' ' 42' ' ' GLU . 30.7 mt -63.85 -38.51 82.53 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 168.268 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.71 -34.69 67.3 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.1 178.474 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.731 ' SG ' ' HA ' ' A' ' 44' ' ' TRP . 18.2 p -72.25 -23.67 61.25 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-O 120.562 0.22 . . . . 0.0 110.502 -179.252 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -67.97 -52.46 35.72 Favored 'General case' 0 CA--C 1.521 -0.139 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 170.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -55.92 -27.72 53.55 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.795 -0.638 . . . . 0.0 110.311 175.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.559 ' HA ' ' HD2' ' A' ' 62' ' ' LYS . 49.9 t80 -69.62 -50.35 45.23 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.991 178.052 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 64.8 pttt -72.52 -21.14 61.23 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 121.252 0.548 . . . . 0.0 110.157 178.684 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -74.68 -38.32 62.43 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.959 -176.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.8 p -63.24 128.68 36.93 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.905 0.383 . . . . 0.0 110.319 176.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -102.35 -1.75 30.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.206 -174.694 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -88.38 115.1 4.34 Favored Glycine 0 CA--C 1.521 0.457 0 C-N-CA 121.109 -0.567 . . . . 0.0 111.848 177.677 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -53.69 -33.84 71.45 Favored 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 122.886 2.391 . . . . 0.0 112.374 -178.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 58.2 mt-30 -65.47 -49.26 69.74 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.598 178.355 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -59.2 -38.53 80.12 Favored 'General case' 0 N--CA 1.461 0.109 0 CA-C-N 115.0 -1.0 . . . . 0.0 110.534 179.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.425 ' O ' ' HE1' ' A' ' 50' ' ' PHE . 43.1 mm -54.38 -53.83 26.93 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.039 178.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.494 ' HA ' ' HG2' ' A' ' 96' ' ' PRO . 17.6 m-70 -63.39 -46.95 84.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.317 -176.325 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 88.8 mt -67.52 -44.05 79.33 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.114 -176.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.559 ' HD2' ' HA ' ' A' ' 50' ' ' PHE . 40.1 ttmt -64.17 -41.01 97.3 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.543 -178.819 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.26 -41.1 92.54 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.416 178.122 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 65.5 tttm -65.88 -38.06 87.79 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.128 178.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.18 -52.14 64.98 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.385 176.623 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 75.4 mt -59.34 -35.99 61.38 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 CA-C-O 121.257 0.551 . . . . 0.0 110.014 178.136 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 90.2 t80 -58.43 -60.95 2.99 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.58 178.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -70.19 -18.21 63.18 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.886 -174.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 85.4 tttt -97.24 -28.76 13.93 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 111.887 0.328 . . . . 0.0 111.887 -174.509 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 70.9 m-85 -130.83 -46.45 1.04 Allowed 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 -173.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 48.0 mm -74.51 -34.2 34.89 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 CA-C-O 121.085 0.469 . . . . 0.0 111.392 -173.296 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.56 ' NE2' ' HB3' ' A' ' 74' ' ' ASP . 0.0 OUTLIER -61.39 137.47 58.24 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.328 -174.386 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 22.9 m -66.01 -24.22 66.72 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 121.387 0.613 . . . . 0.0 109.67 174.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . 0.56 ' HB3' ' NE2' ' A' ' 72' ' ' GLN . 20.8 t70 -106.05 86.26 2.34 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 169.763 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -137.95 152.49 72.25 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.122 -179.517 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_exo -46.8 -48.81 13.4 Favored 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 123.124 2.55 . . . . 0.0 112.857 -178.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.429 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 94.0 mttt -116.32 -37.0 3.86 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.219 178.755 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.429 ' HB2' ' O ' ' A' ' 77' ' ' LYS . 44.0 mt-10 66.49 -177.47 0.2 Allowed 'General case' 0 C--O 1.234 0.279 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 -164.024 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.429 HG21 ' HD1' ' A' ' 43' ' ' PHE . 69.4 t -144.32 141.17 24.39 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 N-CA-C 110.339 -0.245 . . . . 0.0 110.339 177.463 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.621 ' HB2' HD21 ' A' ' 40' ' ' ASN . 34.7 m-80 -64.66 80.91 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.049 176.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 36.6 tp -127.5 143.73 51.15 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.432 -0.803 . . . . 0.0 109.741 179.011 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -50.38 132.2 24.62 Favored 'General case' 0 N--CA 1.466 0.371 0 O-C-N 123.427 0.454 . . . . 0.0 111.193 177.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -62.55 -38.2 89.13 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.911 -177.433 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . 0.468 ' O ' HG23 ' A' ' 88' ' ' VAL . 84.7 t60 -65.41 -36.94 85.47 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 179.005 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 48.3 m -66.38 -41.39 89.46 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.127 175.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -60.95 -41.37 96.18 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 175.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -57.66 -44.1 85.46 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.656 178.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.468 HG23 ' O ' ' A' ' 84' ' ' HIS . 99.4 t -56.93 -44.74 82.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.114 176.203 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 71.8 mt -70.23 -38.19 73.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.321 -177.224 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 41.7 p -65.05 -26.67 68.35 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 120.682 0.277 . . . . 0.0 111.063 -177.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 47.8 m-80 -86.31 -46.05 10.67 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.897 175.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 21.8 m -82.01 -3.61 54.88 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 -173.72 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 7.9 tp -56.38 -23.07 15.82 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 CA-C-O 120.975 0.417 . . . . 0.0 111.342 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 11.6 t -64.1 -33.64 76.22 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.417 -179.081 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 17.2 mm-40 -140.5 76.64 24.72 Favored Pre-proline 0 N--CA 1.466 0.34 0 CA-C-O 120.748 0.309 . . . . 0.0 110.251 -178.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . 0.494 ' HG2' ' HA ' ' A' ' 60' ' ' HIS . 72.0 Cg_endo -76.97 138.26 18.26 Favored 'Trans proline' 0 CA--C 1.531 0.371 0 C-N-CA 122.538 2.159 . . . . 0.0 112.085 179.776 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 5.8 m -105.82 162.72 13.3 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.422 -179.091 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.567 ' H ' HD22 ' A' ' 98' ' ' LEU . 3.9 mm? -15.75 -57.87 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 125.037 1.335 . . . . 0.0 114.006 -177.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 58.6 t60 -146.23 35.83 1.0 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.874 -1.057 . . . . 0.0 109.593 -163.25 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 25.0 t -61.0 -10.99 6.68 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 114.973 -1.012 . . . . 0.0 112.071 -175.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 81.6 m-85 -87.34 14.64 7.59 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.805 -0.179 . . . . 0.0 111.221 178.289 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -59.01 -44.53 91.71 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 120.823 0.344 . . . . 0.0 110.811 -179.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.91 -42.07 97.33 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 121.221 0.534 . . . . 0.0 110.379 177.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.54 -39.34 91.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.631 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -60.47 -44.23 96.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.216 178.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 36.6 t -58.93 -52.12 67.1 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.326 178.191 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . 0.441 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 19.4 mmt180 -54.54 -61.37 2.35 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.159 -179.573 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.447 HG21 ' CD2' ' A' ' 43' ' ' PHE . 59.2 t -57.94 -46.43 87.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.569 -0.742 . . . . 0.0 112.052 -173.785 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 68.3 t80 -57.71 -52.72 64.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.983 -178.384 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . 0.441 ' HG3' ' O ' ' A' ' 107' ' ' ARG . 0.0 OUTLIER -71.93 -31.76 66.67 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.929 0.395 . . . . 0.0 110.887 -176.381 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 31.9 tp -68.94 -38.5 79.53 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.952 -175.109 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . 0.483 ' HB3' HD22 ' A' ' 40' ' ' ASN . 24.4 ptt? -82.4 -22.25 35.46 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 176.709 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . 0.689 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 37.2 tt0 -61.82 -59.61 4.88 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.141 178.27 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -49.14 -35.42 16.52 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.195 -176.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -104.92 -65.93 1.01 Allowed 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 -175.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 33.3 t -63.92 -36.57 84.38 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 111.698 0.258 . . . . 0.0 111.698 -173.139 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . 0.689 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 15.5 t80 -70.0 -40.23 75.41 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 120.453 0.168 . . . . 0.0 110.925 -177.867 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 28.8 p -65.63 -44.26 87.01 Favored 'General case' 0 C--O 1.241 0.648 0 CA-C-O 121.186 0.517 . . . . 0.0 109.966 176.27 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 75.1 mtp85 -57.24 -40.15 77.01 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.077 174.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -61.43 -40.76 95.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.095 176.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 89.8 mt -68.88 -8.96 48.88 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.202 179.286 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . 0.463 ' HD3' ' HA ' ' A' ' 122' ' ' LYS . 0.1 OUTLIER -130.65 20.32 5.11 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 120.917 0.389 . . . . 0.0 111.44 173.608 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 89.1 p -65.92 161.93 20.21 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.949 176.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 15.5 p-10 -62.76 -43.66 98.21 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.354 -179.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.404 ' O ' ' HG ' ' A' ' 129' ' ' LEU . 7.7 tp -62.61 -39.22 83.81 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.607 178.338 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' TYR . . . . . 0.443 ' O ' ' HG2' ' A' ' 130' ' ' MET . 58.0 t80 -66.8 -40.43 88.08 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 110.131 -0.322 . . . . 0.0 110.131 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 83.3 mt -61.74 -37.18 83.27 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.311 177.151 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -62.66 -43.17 99.5 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.188 175.153 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' A' ' 125' ' ' ILE . 95.1 mt -63.73 -30.0 71.15 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.606 176.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' MET . . . . . 0.443 ' HG2' ' O ' ' A' ' 126' ' ' TYR . 21.4 mmt . . . . . 0 N--CA 1.464 0.257 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.619 177.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.7 p . . . . . 0 C--O 1.233 0.193 0 CA-C-O 120.785 0.326 . . . . 0.0 110.319 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 34.8 t -88.91 148.11 40.51 Favored Pre-proline 0 C--N 1.327 -0.404 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 177.052 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_endo -48.62 -33.24 23.52 Favored 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 122.839 2.359 . . . . 0.0 111.869 179.286 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.567 ' O ' HG22 ' A' ' 9' ' ' VAL . 36.3 mt-10 -63.14 -54.16 42.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.143 178.035 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -63.3 -29.29 70.64 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.081 0.467 . . . . 0.0 109.959 178.03 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.22 -40.04 82.2 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.358 -179.348 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.567 HG22 ' O ' ' A' ' 6' ' ' GLU . 25.5 m -71.51 -21.92 21.75 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.269 0 C-N-CA 120.489 -0.484 . . . . 0.0 110.024 177.347 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.596 ' O ' ' HG2' ' A' ' 13' ' ' GLU . 5.6 mptp? -69.52 -16.37 63.42 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.852 173.186 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 42.8 m0 -80.3 -16.46 54.58 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.767 -0.456 . . . . 0.0 109.767 174.47 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -96.02 13.69 65.66 Favored Glycine 0 C--N 1.334 0.45 0 CA-C-N 115.708 -0.678 . . . . 0.0 112.858 -178.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.596 ' HG2' ' O ' ' A' ' 10' ' ' LYS . 11.5 pt-20 -111.78 -28.38 8.11 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 120.881 0.372 . . . . 0.0 110.457 175.708 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.8 m -152.6 117.51 5.12 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.322 -177.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 12.3 t80 -56.58 -36.84 69.8 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 172.223 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -52.19 -45.2 65.09 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 115.069 -0.969 . . . . 0.0 110.858 175.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.554 ' HD2' ' O ' ' A' ' 10' ' ' LYS . 40.4 ttmt -70.19 -36.29 74.52 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.301 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 67.3 tp -58.82 -43.41 90.64 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.078 176.259 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 51.5 tp -74.02 -34.71 64.22 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.574 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 33.6 t -63.81 -28.94 70.21 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.533 179.168 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.449 ' HB3' ' H ' ' A' ' 24' ' ' GLY . 1.5 m-70 -84.49 115.64 22.68 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 175.783 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.63 ' HB3' ' NH1' ' A' ' 22' ' ' ARG . 4.6 ttp-105 -56.49 -31.63 64.23 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 176.438 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -64.06 -46.71 83.16 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.397 176.38 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.449 ' H ' ' HB3' ' A' ' 21' ' ' HIS . . . -62.93 -44.62 97.14 Favored Glycine 0 N--CA 1.45 -0.393 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.658 179.309 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 13.3 tp -52.36 -57.39 9.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.144 0.497 . . . . 0.0 110.475 174.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -58.74 -39.49 81.04 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-N 115.25 -0.886 . . . . 0.0 111.199 -175.434 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -71.4 -45.47 62.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.022 0.439 . . . . 0.0 110.976 179.017 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.478 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 74.2 t80 -72.98 -30.28 63.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.226 -174.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 13.6 t -76.02 -39.09 56.44 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 -177.748 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 37.2 ttt180 -59.72 -39.37 84.45 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.905 171.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.512 ' O ' HG22 ' A' ' 34' ' ' THR . 68.0 t80 -62.59 -53.45 54.39 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.822 -178.502 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.599 HD13 ' HA ' ' A' ' 38' ' ' GLU . 2.7 pp -73.91 -16.12 61.11 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 120.761 0.315 . . . . 0.0 111.406 -179.493 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.616 ' HD2' ' HB3' ' A' ' 38' ' ' GLU . 12.7 mptt -65.38 -50.23 66.32 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 120.962 0.41 . . . . 0.0 110.086 175.785 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.512 HG22 ' O ' ' A' ' 31' ' ' PHE . 13.8 t -68.66 -17.96 64.19 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.885 -174.262 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.557 ' HG2' ' HA ' ' A' ' 32' ' ' LEU . 12.5 pt-20 -97.56 8.76 44.05 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.736 0.303 . . . . 0.0 110.631 176.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 91.7 m-85 57.96 39.58 26.42 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.727 173.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 26.1 m -124.81 34.59 4.96 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.446 0.641 . . . . 0.0 109.3 177.179 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.616 ' HB3' ' HD2' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -83.43 -30.75 27.06 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.13 -0.941 . . . . 0.0 112.857 -170.079 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.437 ' HB3' ' NZ ' ' A' ' 77' ' ' LYS . 0.4 OUTLIER -57.71 -22.25 45.27 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 120.823 -0.351 . . . . 0.0 110.9 -177.058 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.538 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 58.1 m-80 -66.74 -50.46 62.69 Favored 'General case' 0 C--O 1.239 0.514 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.435 179.06 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.431 HG22 ' O ' ' A' ' 38' ' ' GLU . 13.9 tt -69.38 -40.67 80.31 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 C-N-CA 120.916 -0.314 . . . . 0.0 110.191 -178.751 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -61.69 -30.94 71.07 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.404 175.128 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.538 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 78.4 t80 -59.87 -66.58 0.49 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.405 179.603 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.643 ' HB2' ' HG3' ' A' ' 105' ' ' GLN . 47.2 p-90 -75.55 -18.5 59.75 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 120.176 -0.61 . . . . 0.0 112.516 -171.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 13.0 tt -73.39 -32.8 38.42 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 173.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.56 -27.69 65.34 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.927 -0.578 . . . . 0.0 109.904 174.346 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.506 ' SG ' ' HB2' ' A' ' 101' ' ' PHE . 41.4 t -68.83 -42.96 76.49 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.181 175.134 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 18.2 tp10 -65.1 -36.95 85.92 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 176.317 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.595 ' HA ' ' HE3' ' A' ' 52' ' ' LYS . 10.4 t70 -64.9 -38.26 90.38 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.378 173.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.491 ' HA ' ' HE2' ' A' ' 62' ' ' LYS . 8.5 t80 -56.15 -39.89 73.01 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.626 177.375 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.599 ' NZ ' ' HB2' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -97.47 -5.28 36.37 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.826 0.676 . . . . 0.0 112.826 -173.656 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.595 ' HE3' ' HA ' ' A' ' 49' ' ' ASP . 18.4 ptpt -74.38 -28.4 61.09 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 175.267 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.2 p -74.24 150.5 40.26 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.982 174.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.64 4.7 5.54 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 111.678 0.251 . . . . 0.0 111.678 -177.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . 0.494 ' O ' HG12 ' A' ' 59' ' ' ILE . . . -75.12 120.44 6.2 Favored Glycine 0 CA--C 1.52 0.372 0 N-CA-C 111.169 -0.772 . . . . 0.0 111.169 175.652 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.45 ' O ' ' HD2' ' A' ' 60' ' ' HIS . 72.0 Cg_exo -49.0 -62.3 0.45 Allowed 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 122.878 2.386 . . . . 0.0 112.777 -175.498 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.83 -34.52 74.68 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 120.903 0.382 . . . . 0.0 110.519 -179.224 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.459 HE21 ' HD2' ' A' ' 62' ' ' LYS . 56.3 tp60 -60.65 -41.39 94.91 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.955 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.494 HG12 ' O ' ' A' ' 55' ' ' GLY . 44.2 mm -59.0 -41.44 83.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.683 179.096 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.45 ' HD2' ' O ' ' A' ' 56' ' ' PRO . 77.6 m-70 -64.95 -50.46 66.3 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.443 -177.237 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.458 HD12 ' N ' ' A' ' 62' ' ' LYS . 4.4 pp -70.54 -31.02 67.92 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.476 -175.309 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.491 ' HE2' ' HA ' ' A' ' 50' ' ' PHE . 60.5 mtpt -71.93 -41.73 67.49 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 120.777 0.323 . . . . 0.0 110.299 176.82 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.475 ' HB2' ' CE1' ' A' ' 50' ' ' PHE . . . -60.85 -44.69 96.67 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.691 178.427 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -65.51 -41.12 93.52 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.629 -177.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.99 -50.54 73.7 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-O 121.067 0.46 . . . . 0.0 110.567 177.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 70.1 mt -62.57 -38.19 80.85 Favored 'Isoleucine or valine' 0 C--O 1.231 0.127 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.327 178.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.577 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 49.1 t80 -55.74 -59.84 4.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.635 178.073 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -67.55 -24.61 65.55 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.427 -0.806 . . . . 0.0 112.603 -170.543 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -105.49 -25.41 12.34 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -176.051 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . 0.529 ' HB3' ' HD1' ' A' ' 43' ' ' PHE . 96.4 m-85 -125.04 -46.12 1.83 Allowed 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 112.678 0.622 . . . . 0.0 112.678 -171.725 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.577 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 48.4 mm -71.04 -37.93 69.62 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 CA-C-O 120.944 0.402 . . . . 0.0 110.647 -173.473 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.405 ' OE1' ' HA ' ' A' ' 72' ' ' GLN . 5.8 tp60 -72.64 129.41 38.19 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.227 179.397 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 27.2 m -60.17 -44.1 95.31 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.204 0.526 . . . . 0.0 110.103 178.077 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -74.82 79.33 2.1 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.152 175.254 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -132.3 156.82 79.64 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.727 -175.588 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -67.74 -30.32 34.34 Favored 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 122.704 2.269 . . . . 0.0 112.259 -179.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.437 ' NZ ' ' HB3' ' A' ' 39' ' ' GLU . 26.0 tptp -105.0 -39.4 6.26 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.981 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.436 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 51.5 mt-10 69.3 154.27 0.11 Allowed 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.297 -177.377 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.433 HG21 ' CD1' ' A' ' 43' ' ' PHE . 88.2 t -140.05 147.86 23.25 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.496 175.603 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -86.79 87.75 7.52 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.122 0.487 . . . . 0.0 109.97 178.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.495 HD11 HG21 ' A' ' 85' ' ' THR . 37.3 tp -134.86 145.67 48.51 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.79 -177.853 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -54.73 158.9 2.42 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-N 115.683 -0.69 . . . . 0.0 112.487 -177.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 55.7 m-85 -73.69 -57.25 4.11 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.79 -177.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . 0.447 ' O ' HG23 ' A' ' 88' ' ' VAL . 86.3 t60 -64.27 -31.03 72.08 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.996 -175.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.495 HG21 HD11 ' A' ' 81' ' ' LEU . 76.0 m -59.61 -51.76 68.43 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.67 179.205 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 9.7 ptpp? -71.24 -25.27 62.41 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.263 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -63.53 -41.64 98.47 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 121.231 0.539 . . . . 0.0 110.233 176.047 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 84' ' ' HIS . 81.3 t -64.06 -37.97 81.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 121.25 0.547 . . . . 0.0 109.66 174.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 75.6 mt -66.14 -40.3 86.71 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.258 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.424 ' O ' HG22 ' A' ' 93' ' ' ILE . 40.2 p -61.78 -36.13 80.16 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 120.991 0.424 . . . . 0.0 110.376 179.483 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 28.7 m-80 -73.68 -29.23 62.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.903 175.316 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 50.5 m -94.8 -2.7 50.39 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -175.593 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.424 HG22 ' O ' ' A' ' 90' ' ' THR . 9.9 tp -61.35 -27.58 42.18 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.384 0 CA-C-O 120.874 0.369 . . . . 0.0 110.924 -177.269 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 15.0 t -78.97 -18.29 53.98 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.099 -178.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -140.58 75.66 26.01 Favored Pre-proline 0 N--CA 1.465 0.313 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.28 -179.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -75.08 143.07 28.36 Favored 'Trans proline' 0 C--O 1.236 0.377 0 C-N-CA 122.398 2.065 . . . . 0.0 111.688 178.391 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.495 HG22 ' H ' ' A' ' 98' ' ' LEU . 3.4 m -130.09 168.43 16.78 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 -178.701 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.495 ' H ' HG22 ' A' ' 97' ' ' THR . 3.2 mm? -64.71 3.73 0.49 Allowed 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 -170.119 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -157.14 19.72 0.3 Allowed 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 118.485 0.584 . . . . 0.0 111.854 174.301 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 30.0 m -55.21 -37.1 66.69 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 121.035 0.445 . . . . 0.0 111.789 -178.071 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.506 ' HB2' ' SG ' ' A' ' 47' ' ' CYS . 10.7 m-85 -89.79 16.89 7.27 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.519 -175.416 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -69.83 -32.96 71.67 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 120.85 0.357 . . . . 0.0 110.51 -177.606 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.9 -43.94 97.82 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 121.188 0.518 . . . . 0.0 109.943 176.148 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.13 -42.72 96.71 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.033 177.146 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.643 ' HG3' ' HB2' ' A' ' 44' ' ' TRP . 57.4 tt0 -57.34 -42.7 82.46 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.406 177.721 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 46.7 t -63.17 -53.22 56.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.996 -179.577 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . 0.436 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 20.0 mmm180 -57.21 -44.81 84.04 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.86 -174.342 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 57.7 t -77.26 -37.32 25.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.144 -175.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -60.57 -52.35 65.55 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.595 176.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . 0.436 ' HG3' ' O ' ' A' ' 107' ' ' ARG . 0.0 OUTLIER -64.53 -31.31 72.47 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.064 0.459 . . . . 0.0 110.298 -178.745 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.414 ' HB2' ' O ' ' A' ' 107' ' ' ARG . 31.7 tp -65.74 -44.01 87.25 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.831 -176.579 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 28.1 mtm -72.49 -34.53 67.74 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 177.157 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . 0.602 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 7.1 tm-20 -57.56 -63.3 1.28 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.552 -178.328 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -54.8 -26.04 32.18 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.115 -0.493 . . . . 0.0 112.128 -174.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -103.66 -74.26 0.65 Allowed 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 120.803 0.335 . . . . 0.0 111.795 -176.459 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 15.6 t -64.84 -31.94 73.41 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.923 -170.442 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . 0.602 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 38.3 t80 -63.85 -40.88 97.6 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.617 0.246 . . . . 0.0 111.051 -176.743 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 63.5 p -61.72 -45.92 91.87 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-O 121.536 0.684 . . . . 0.0 109.965 179.177 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 52.8 mtp180 -59.58 -41.27 89.87 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.145 176.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 77.6 t80 -59.53 -34.2 72.34 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.46 179.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 94.5 mt -71.05 -26.01 62.9 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.161 178.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -115.89 21.43 13.82 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.393 177.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 97.9 p -75.7 152.21 37.53 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 120.645 0.26 . . . . 0.0 110.785 179.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -61.48 -29.14 69.78 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.353 0.597 . . . . 0.0 109.4 176.038 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.427 ' O ' ' HG ' ' A' ' 129' ' ' LEU . 45.2 mm -61.24 -52.93 55.69 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 115.087 -0.96 . . . . 0.0 110.21 174.343 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' TYR . . . . . 0.433 ' O ' ' HG2' ' A' ' 130' ' ' MET . 53.0 t80 -62.73 -38.74 91.68 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.587 -177.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 97.7 mt -60.77 -33.69 73.34 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.323 177.538 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -74.65 -34.3 62.7 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.373 177.192 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 125' ' ' ILE . 85.7 mt -71.26 -18.24 62.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.61 178.275 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' MET . . . . . 0.433 ' HG2' ' O ' ' A' ' 126' ' ' TYR . 21.6 mmt . . . . . 0 CA--C 1.533 0.321 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.913 178.634 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.446 HG21 ' CZ2' ' A' ' 11' ' ' TRP . 7.1 p . . . . . 0 C--O 1.235 0.333 0 CA-C-O 120.88 0.371 . . . . 0.0 111.502 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.7 m -76.83 151.54 82.32 Favored Pre-proline 0 C--O 1.236 0.362 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.334 176.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -53.59 -34.89 75.1 Favored 'Trans proline' 0 C--N 1.351 0.67 0 C-N-CA 122.877 2.385 . . . . 0.0 112.652 -177.192 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 46.3 mm-40 -60.48 -52.87 63.35 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.966 -179.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.533 ' HA ' ' HE2' ' A' ' 10' ' ' LYS . 22.1 tp10 -65.27 -37.8 88.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.074 178.565 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.07 -53.56 57.0 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.232 -179.554 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.797 HG12 ' SD ' ' A' ' 130' ' ' MET . 22.9 m -66.94 -25.55 34.68 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-O 121.26 0.553 . . . . 0.0 110.572 -179.589 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.551 ' HG2' ' HE2' ' A' ' 17' ' ' LYS . 35.2 ttpt -76.14 -9.52 58.69 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.396 -175.618 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.446 ' CZ2' HG21 ' A' ' 3' ' ' VAL . 45.9 m0 -66.98 -18.22 65.28 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.419 0.152 . . . . 0.0 111.1 177.773 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -76.26 60.87 3.13 Favored Glycine 0 C--N 1.333 0.374 0 CA-C-N 116.098 -0.501 . . . . 0.0 112.829 -177.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -150.74 -39.41 0.13 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.0 0.429 . . . . 0.0 110.34 176.322 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.413 ' HB3' ' OD1' ' A' ' 16' ' ' ASP . 69.3 m -142.1 125.08 16.17 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.678 -176.649 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.403 ' CZ ' ' SD ' ' A' ' 112' ' ' MET . 33.9 t80 -58.95 -40.21 84.01 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.028 178.489 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.413 ' OD1' ' HB3' ' A' ' 14' ' ' SER . 7.9 p-10 -64.66 -29.74 70.75 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.641 -0.708 . . . . 0.0 110.862 179.509 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.551 ' HE2' ' HG2' ' A' ' 10' ' ' LYS . 65.7 tttp -65.87 -38.22 88.21 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 121.163 0.506 . . . . 0.0 109.828 176.84 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.455 HD21 ' HB2' ' A' ' 28' ' ' PHE . 54.5 tp -59.91 -48.05 83.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.248 176.467 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -72.55 -25.56 61.4 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.178 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 30.2 t -60.02 -27.73 67.15 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 121.326 0.584 . . . . 0.0 109.572 176.119 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 71.5 m-70 -100.46 118.9 37.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.52 176.272 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 92.4 mtt180 -64.48 -27.34 68.92 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.87 0.367 . . . . 0.0 110.083 179.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -65.21 -41.28 94.63 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.861 172.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -67.7 -45.73 73.62 Favored Glycine 0 C--N 1.331 0.274 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.522 178.479 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 7.7 tt -54.74 -42.6 71.8 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.166 -0.517 . . . . 0.0 110.003 175.457 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.487 ' O ' ' HG2' ' A' ' 30' ' ' ARG . 19.2 tp10 -58.03 -53.77 54.46 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.267 178.849 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -61.14 -40.2 92.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.262 -178.122 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.455 ' HB2' HD21 ' A' ' 18' ' ' LEU . 80.9 t80 -68.47 -48.7 63.82 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.201 -176.804 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.8 t -61.61 -34.51 75.78 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-O 120.72 0.295 . . . . 0.0 110.339 -177.44 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.487 ' HG2' ' O ' ' A' ' 26' ' ' GLU . 26.5 mmt180 -59.38 -52.0 67.49 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.335 176.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -64.35 -42.23 96.33 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.669 179.054 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.407 HD22 ' CE2' ' A' ' 28' ' ' PHE . 13.7 tp -65.55 -27.62 68.57 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.582 -176.036 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.563 ' HG2' ' HB3' ' A' ' 38' ' ' GLU . 56.9 mttm -75.13 -43.93 49.88 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.082 177.104 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.1 t -71.41 -17.95 62.37 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 120.93 0.395 . . . . 0.0 110.177 177.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -92.09 13.47 18.8 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.632 174.552 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 41.7 p90 46.61 22.75 0.19 Allowed 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.353 1.061 . . . . 0.0 112.87 178.258 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 24.4 m -107.98 18.28 21.42 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.102 0.477 . . . . 0.0 110.153 179.049 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.563 ' HB3' ' HG2' ' A' ' 33' ' ' LYS . 11.6 pt-20 -54.23 -19.88 5.99 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.824 -178.324 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -49.84 -48.02 51.27 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.906 176.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 10.1 m120 -57.42 -61.28 2.6 Favored 'General case' 0 C--O 1.244 0.799 0 CA-C-O 121.133 0.492 . . . . 0.0 111.878 -173.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.566 HG23 ' HG3' ' A' ' 42' ' ' GLU . 7.1 tp -56.3 -46.88 81.78 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.36 -177.467 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.566 ' HG3' HG23 ' A' ' 41' ' ' ILE . 46.9 mt-10 -78.6 -11.82 59.99 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.412 -176.333 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -70.74 -65.89 0.68 Allowed 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 116.561 -0.29 . . . . 0.0 110.32 177.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.487 ' HA ' ' SG ' ' A' ' 47' ' ' CYS . 22.8 p-90 -73.3 -19.51 61.02 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 119.6 -0.84 . . . . 0.0 111.484 -177.003 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 11.0 mt -60.56 -42.6 92.14 Favored 'Isoleucine or valine' 0 C--O 1.236 0.384 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 167.784 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.8 -28.73 62.75 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.914 178.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.509 ' O ' ' HB3' ' A' ' 50' ' ' PHE . 77.3 m -66.04 -37.06 84.9 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.798 179.233 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -77.93 -26.89 49.2 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.824 177.443 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.781 ' HA ' ' HE3' ' A' ' 52' ' ' LYS . 16.0 t70 -63.78 -39.37 94.08 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.577 0.703 . . . . 0.0 109.235 169.683 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.509 ' HB3' ' O ' ' A' ' 47' ' ' CYS . 91.4 t80 -61.51 -44.56 96.85 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.668 -1.151 . . . . 0.0 109.921 175.043 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.426 ' HA ' ' O ' ' A' ' 98' ' ' LEU . 23.7 ttpp -58.68 -39.22 80.07 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.831 -177.821 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.781 ' HE3' ' HA ' ' A' ' 49' ' ' ASP . 23.2 pttp -83.82 1.59 42.32 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 120.777 0.322 . . . . 0.0 111.647 -176.55 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 14.6 m -103.35 54.35 0.76 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.76 0.79 . . . . 0.0 108.934 175.265 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.93 -4.73 2.34 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.325 -1.307 . . . . 0.0 113.807 -167.511 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -61.24 116.27 9.1 Favored Glycine 0 C--O 1.224 -0.477 0 C-N-CA 120.533 -0.841 . . . . 0.0 111.25 177.554 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -44.72 -47.53 11.45 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 123.419 2.746 . . . . 0.0 113.133 -173.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . 0.459 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 50.8 mt-30 -63.37 -50.66 69.06 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 121.021 0.439 . . . . 0.0 109.844 178.686 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -55.97 -37.65 69.35 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.599 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.5 HG23 ' CZ ' ' A' ' 50' ' ' PHE . 23.9 mm -57.74 -53.02 50.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.714 178.035 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 14.0 m-70 -63.38 -36.18 82.86 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.748 0.308 . . . . 0.0 110.682 -178.061 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.459 ' HG ' ' O ' ' A' ' 57' ' ' GLN . 88.5 mt -64.92 -50.56 66.0 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.931 -179.72 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -69.89 -36.47 75.45 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.872 -178.236 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.76 -48.24 82.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.674 179.553 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 20.3 tptp -68.38 -29.75 68.52 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.192 -179.266 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -65.81 -61.35 2.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.076 175.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 71.2 mt -55.2 -32.99 29.26 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.168 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.581 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.481 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 77.2 t80 -54.77 -66.16 0.45 Allowed 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.535 177.789 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.41 ' HG3' ' HD2' ' A' ' 67' ' ' TYR . 38.0 mt-10 -76.88 -12.34 59.95 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.911 -174.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 54.3 tptt -92.82 -32.84 14.49 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.247 -177.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . 0.425 ' HB3' ' CG2' ' A' ' 79' ' ' VAL . 80.5 m-85 -133.49 -49.32 0.84 Allowed 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -172.934 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.481 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 49.8 mm -67.53 -28.25 41.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 CA-C-O 121.096 0.475 . . . . 0.0 111.071 -171.486 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.542 ' HB3' ' HB2' ' A' ' 75' ' ' ALA . 0.0 OUTLIER -65.49 125.9 26.62 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.493 178.677 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 25.0 m -58.38 -30.03 66.48 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 121.27 0.557 . . . . 0.0 110.426 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 42.1 m-20 -109.42 94.02 4.82 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 170.675 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.542 ' HB2' ' HB3' ' A' ' 72' ' ' GLN . . . -152.37 164.89 18.84 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 115.439 -0.801 . . . . 0.0 109.832 -176.244 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.403 ' HD2' ' HB1' ' A' ' 75' ' ' ALA . 82.1 Cg_exo -46.77 -45.35 20.44 Favored 'Trans proline' 0 C--N 1.357 0.974 0 C-N-CA 122.643 2.228 . . . . 0.0 112.299 178.556 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -130.51 89.96 2.85 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 173.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.412 ' O ' ' HG2' ' A' ' 78' ' ' GLU . 0.6 OUTLIER -68.6 117.19 10.02 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.437 -179.12 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.425 ' CG2' ' HB3' ' A' ' 70' ' ' PHE . 97.3 t -69.31 138.81 21.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.615 178.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -79.45 30.72 0.23 Allowed 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.151 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.437 HD11 HG21 ' A' ' 85' ' ' THR . 39.4 tp -75.06 146.03 41.84 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.706 -175.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -53.04 145.94 12.12 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.26 -0.882 . . . . 0.0 112.052 178.569 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.417 ' HA ' ' HG2' ' A' ' 86' ' ' LYS . 39.9 p90 -66.71 -38.97 87.79 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.38 -176.336 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 79.8 t60 -69.42 -35.02 75.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.842 0.353 . . . . 0.0 110.361 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.437 HG21 HD11 ' A' ' 81' ' ' LEU . 21.4 m -70.34 -45.77 65.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.739 -179.56 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.487 ' O ' HG23 ' A' ' 90' ' ' THR . 19.3 ptpt -64.64 -31.12 72.2 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 178.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -58.73 -47.49 84.43 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.197 176.305 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 65.0 t -58.74 -43.08 87.04 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 CA-C-O 121.036 0.446 . . . . 0.0 110.284 177.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 65.0 mt -61.69 -46.9 95.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.17 -179.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.487 HG23 ' O ' ' A' ' 86' ' ' LYS . 78.8 p -60.26 -42.77 96.03 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.099 0.476 . . . . 0.0 110.864 -177.443 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -83.75 -7.01 59.57 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.96 -0.564 . . . . 0.0 112.143 -176.48 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 23.7 m -124.03 6.15 8.6 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 11.1 tp -67.25 -21.39 27.89 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 CA-C-O 120.999 0.428 . . . . 0.0 110.464 -178.031 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 9.9 t -58.73 -36.87 75.0 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.169 178.201 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -141.46 83.95 12.92 Favored Pre-proline 0 C--O 1.233 0.197 0 CA-C-O 120.953 0.406 . . . . 0.0 110.23 -179.379 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . 0.464 ' HG2' HG22 ' A' ' 59' ' ' ILE . 86.2 Cg_endo -81.55 156.56 18.87 Favored 'Trans proline' 0 CA--C 1.532 0.411 0 C-N-CA 122.714 2.276 . . . . 0.0 112.298 178.771 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.405 ' H ' ' HB2' ' A' ' 100' ' ' SER . 62.8 p -86.78 -171.82 3.71 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.575 176.594 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.426 ' O ' ' HA ' ' A' ' 51' ' ' LYS . 34.8 tp -51.04 -37.43 45.35 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.189 0.519 . . . . 0.0 110.847 -177.621 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -152.29 76.84 1.18 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.586 0.708 . . . . 0.0 109.537 170.803 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . 0.405 ' HB2' ' H ' ' A' ' 97' ' ' THR . 13.1 t -58.83 -19.33 40.42 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 115.172 -0.922 . . . . 0.0 111.485 -176.346 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 75.9 m-85 -77.31 6.22 7.19 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.868 -179.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -52.16 -50.86 60.95 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 122.966 0.506 . . . . 0.0 111.034 177.631 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.422 ' O ' ' HD3' ' A' ' 107' ' ' ARG . . . -61.05 -42.58 98.75 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.535 179.253 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.19 -43.25 99.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.616 179.033 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 25.4 tt0 -54.53 -44.44 72.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.373 177.786 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . 0.439 ' O ' ' HG2' ' A' ' 110' ' ' GLN . 32.1 m -56.96 -47.47 80.62 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.512 179.712 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . 0.458 ' O ' ' HG ' ' A' ' 111' ' ' LEU . 12.5 mpt_? -62.9 -63.93 1.06 Allowed 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.548 178.602 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.485 ' O ' ' HG3' ' A' ' 112' ' ' MET . 80.2 t -50.82 -42.45 23.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.435 -175.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 32.5 t80 -56.99 -59.53 4.92 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.119 179.159 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . 0.439 ' HG2' ' O ' ' A' ' 106' ' ' SER . 4.1 pt20 -71.26 -20.56 62.21 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 120.553 0.216 . . . . 0.0 111.455 -174.854 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' A' ' 107' ' ' ARG . 76.3 mt -69.65 -41.11 76.0 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.805 -0.18 . . . . 0.0 111.006 178.76 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . 0.485 ' HG3' ' O ' ' A' ' 108' ' ' VAL . 0.0 OUTLIER -91.55 -12.02 35.63 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 120.955 -0.298 . . . . 0.0 110.79 178.932 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . 0.512 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 42.5 tt0 -68.05 -56.71 7.88 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 171.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -58.28 -22.88 54.35 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.226 -176.157 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -110.91 -69.28 0.88 Allowed 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 120.976 0.417 . . . . 0.0 111.089 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . 0.48 ' HA ' ' HB3' ' A' ' 119' ' ' ARG . 22.1 m -69.58 -17.92 63.59 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 -168.805 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . 0.512 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 22.5 t80 -68.46 -60.44 2.43 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 118.116 0.417 . . . . 0.0 110.431 177.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 20.6 p -65.12 -34.47 78.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.314 0.578 . . . . 0.0 110.272 178.402 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . 0.48 ' HB3' ' HA ' ' A' ' 116' ' ' SER . 16.3 ttt180 -55.29 -46.8 76.2 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 114.953 -1.021 . . . . 0.0 109.472 173.313 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -65.62 -41.5 92.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.346 177.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.453 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 90.5 mt -58.21 -25.57 61.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.633 0.254 . . . . 0.0 111.21 -179.452 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 11.4 mptt -113.65 7.96 17.44 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 179.083 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 78.4 p -69.41 140.77 54.17 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 171.289 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -54.43 -33.49 59.58 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 111.522 0.193 . . . . 0.0 111.522 -179.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 9.9 tp -66.31 -40.81 87.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 CA-C-O 120.743 0.306 . . . . 0.0 110.878 -178.611 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' TYR . . . . . 0.535 ' O ' ' HG2' ' A' ' 130' ' ' MET . 84.7 t80 -72.17 -43.24 64.89 Favored 'General case' 0 C--O 1.232 0.176 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 176.349 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 91.4 mt -61.86 -23.79 66.5 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.199 177.351 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -68.58 -43.56 76.26 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.133 173.094 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 80.9 mt -61.65 -29.4 70.04 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.242 176.338 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' MET . . . . . 0.797 ' SD ' HG12 ' A' ' 9' ' ' VAL . 19.4 mmt . . . . . 0 C--O 1.235 0.315 0 CA-C-O 121.632 0.73 . . . . 0.0 110.498 -179.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.402 HG21 ' CH2' ' A' ' 11' ' ' TRP . 3.2 p . . . . . 0 C--O 1.233 0.224 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 17.6 m -62.13 136.24 95.28 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.109 179.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.467 ' HA ' ' HB3' ' A' ' 8' ' ' ALA . 8.2 Cg_endo -49.72 -26.77 13.81 Favored 'Trans proline' 0 C--N 1.355 0.872 0 C-N-CA 123.186 2.591 . . . . 0.0 112.464 -178.149 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.594 ' O ' HG22 ' A' ' 9' ' ' VAL . 32.8 tt0 -58.53 -58.06 10.2 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.16 176.168 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -59.25 -37.1 76.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.252 0.548 . . . . 0.0 110.187 175.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.467 ' HB3' ' HA ' ' A' ' 5' ' ' PRO . . . -62.5 -39.75 94.5 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.663 -177.642 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.594 HG22 ' O ' ' A' ' 6' ' ' GLU . 27.0 m -72.1 -26.58 25.3 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.297 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.261 178.011 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.587 ' HG2' ' O ' ' A' ' 6' ' ' GLU . 14.4 mmmm -63.31 -38.15 90.03 Favored 'General case' 0 N--CA 1.463 0.207 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 174.702 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.402 ' CH2' HG21 ' A' ' 3' ' ' VAL . 54.0 m0 -61.33 -29.65 70.02 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.634 176.168 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -74.42 6.96 20.49 Favored Glycine 0 CA--C 1.521 0.443 0 CA-C-N 115.64 -0.709 . . . . 0.0 113.719 -176.308 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.502 ' HG3' ' O ' ' A' ' 10' ' ' LYS . 0.0 OUTLIER -132.49 12.0 4.5 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 117.475 0.638 . . . . 0.0 111.244 176.391 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.418 ' HB3' ' HG2' ' A' ' 17' ' ' LYS . 44.2 t -171.0 100.59 0.21 Allowed 'General case' 0 C--O 1.237 0.444 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.169 176.863 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.429 ' HD1' HD23 ' A' ' 18' ' ' LEU . 37.0 t80 -55.12 -29.02 56.82 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.36 176.418 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -57.59 -52.06 66.94 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.994 -179.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.418 ' HG2' ' HB3' ' A' ' 14' ' ' SER . 17.7 ptpt -74.42 -28.39 61.05 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 120.946 -0.302 . . . . 0.0 110.533 -174.837 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.429 HD23 ' HD1' ' A' ' 15' ' ' PHE . 16.4 tp -57.19 -51.36 69.62 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.018 173.893 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.554 HD12 ' HA ' ' A' ' 25' ' ' LEU . 15.7 tp -82.9 -22.54 33.9 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.821 -175.508 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 23.2 t -76.71 -25.73 53.91 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.278 178.21 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -73.59 120.87 19.79 Favored 'General case' 0 C--O 1.222 -0.347 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 177.911 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.441 ' O ' ' HB3' ' A' ' 25' ' ' LEU . 60.9 mtp180 -43.06 -56.65 3.25 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.226 0.61 . . . . 0.0 112.551 -173.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -72.56 -26.52 61.76 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.816 0.341 . . . . 0.0 110.469 -178.381 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -68.17 -34.55 81.18 Favored Glycine 0 C--N 1.333 0.397 0 N-CA-C 111.384 -0.686 . . . . 0.0 111.384 176.325 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.554 ' HA ' HD12 ' A' ' 19' ' ' LEU . 9.3 tp -58.31 -54.72 43.83 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.536 0.684 . . . . 0.0 109.505 174.423 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.482 ' O ' ' HG2' ' A' ' 30' ' ' ARG . 8.8 tp10 -61.59 -34.58 75.86 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 114.715 -1.13 . . . . 0.0 110.459 -179.408 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.543 ' O ' ' HB2' ' A' ' 30' ' ' ARG . . . -68.28 -52.25 35.87 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 121.053 0.454 . . . . 0.0 111.153 179.323 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -64.75 -39.54 93.8 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.656 -177.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.539 ' OG1' ' HE2' ' A' ' 33' ' ' LYS . 3.6 t -64.31 -33.25 75.4 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 -179.482 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.543 ' HB2' ' O ' ' A' ' 27' ' ' ALA . 67.1 mmt-85 -52.43 -51.2 60.4 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.295 0.569 . . . . 0.0 109.556 171.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.464 ' O ' HG22 ' A' ' 34' ' ' THR . 69.2 t80 -64.56 -46.81 81.19 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 114.991 -1.004 . . . . 0.0 110.864 -178.158 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.567 ' HG ' ' H ' ' A' ' 38' ' ' GLU . 23.1 tp -70.48 -23.23 62.64 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.418 -175.583 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.539 ' HE2' ' OG1' ' A' ' 29' ' ' THR . 68.4 mttm -86.1 -34.15 20.73 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.771 -0.195 . . . . 0.0 110.964 178.53 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.464 HG22 ' O ' ' A' ' 31' ' ' PHE . 14.3 t -72.37 -22.94 61.07 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 121.08 -0.248 . . . . 0.0 110.854 -178.202 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.434 ' CD ' HH12 ' A' ' 119' ' ' ARG . 12.6 pt-20 -88.27 5.04 43.66 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 120.978 0.418 . . . . 0.0 110.028 174.088 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 33.0 t80 68.7 26.93 6.05 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.63 174.073 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 50.1 m -91.96 -78.52 0.4 Allowed 'General case' 0 CA--C 1.532 0.264 0 O-C-N 122.06 -0.4 . . . . 0.0 110.016 176.312 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.567 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 32.8 tt0 67.37 -64.61 0.25 Allowed 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 112.959 0.726 . . . . 0.0 112.959 175.667 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -39.32 -38.95 0.58 Allowed 'General case' 0 C--O 1.22 -0.484 0 C-N-CA 123.899 0.88 . . . . 0.0 113.061 -174.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.535 ' HB2' HD21 ' A' ' 32' ' ' LEU . 43.2 m-80 -50.43 -68.89 0.13 Allowed 'General case' 0 C--O 1.242 0.665 0 CA-C-O 121.062 0.458 . . . . 0.0 111.879 -176.668 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.493 HD12 HD11 ' A' ' 19' ' ' LEU . 3.7 tt -61.95 -44.33 98.76 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.857 -176.346 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -62.89 -31.59 72.68 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.081 -179.053 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 66.2 t80 -65.29 -66.71 0.51 Allowed 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.353 -177.209 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.498 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 33.6 p-90 -71.23 -23.97 62.1 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 119.707 -0.797 . . . . 0.0 111.805 -171.957 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 14.7 tt -66.85 -36.26 76.75 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 C-N-CA 120.213 -0.595 . . . . 0.0 109.592 177.1 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.0 -33.09 75.02 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 121.26 0.552 . . . . 0.0 109.887 173.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 72.5 m -70.4 -29.16 65.72 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.364 177.131 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.568 ' O ' ' HG3' ' A' ' 52' ' ' LYS . 37.0 mm-40 -72.93 -30.86 64.22 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 116.671 -0.24 . . . . 0.0 110.517 177.162 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.812 ' HA ' ' HE3' ' A' ' 52' ' ' LYS . 30.3 t70 -61.08 -42.18 98.03 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 172.126 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -63.46 -35.81 81.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.048 174.092 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.535 ' HB2' ' HA ' ' A' ' 48' ' ' GLU . 1.1 tppp? -59.28 -29.45 67.6 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.964 178.136 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.812 ' HE3' ' HA ' ' A' ' 49' ' ' ASP . 9.4 mtmp? -87.46 -19.6 27.77 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.104 -179.03 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 18.8 m -73.36 82.09 1.4 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.343 0.592 . . . . 0.0 111.102 -173.653 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.431 ' HD3' ' O ' ' A' ' 54' ' ' LYS . 0.0 OUTLIER -76.02 103.85 6.27 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.84 178.326 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . 0.524 ' O ' HG12 ' A' ' 59' ' ' ILE . . . 173.1 119.84 0.54 Allowed Glycine 0 N--CA 1.45 -0.406 0 N-CA-C 110.93 -0.868 . . . . 0.0 110.93 178.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_endo -55.35 -46.77 30.04 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.74 2.293 . . . . 0.0 112.348 -174.475 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . 0.462 ' NE2' HE21 ' A' ' 58' ' ' GLN . 7.9 pm0 -67.75 -34.46 76.86 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.192 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.462 HE21 ' NE2' ' A' ' 57' ' ' GLN . 66.5 mm-40 -63.38 -40.76 98.11 Favored 'General case' 0 N--CA 1.462 0.14 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 179.149 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.525 HG22 ' HG2' ' A' ' 96' ' ' PRO . 47.3 mm -54.51 -42.03 57.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.907 -179.663 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 32.5 m-70 -67.57 -56.1 10.78 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.194 -178.161 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.476 HD12 ' N ' ' A' ' 62' ' ' LYS . 3.9 pp -73.2 -34.46 65.98 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 112.534 0.568 . . . . 0.0 112.534 -171.191 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.476 ' N ' HD12 ' A' ' 61' ' ' LEU . 47.1 mtpt -75.95 -40.72 53.41 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 120.869 -0.333 . . . . 0.0 110.675 179.506 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.15 -41.71 97.07 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.879 0.371 . . . . 0.0 110.228 177.393 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 15.9 tppt? -60.39 -41.51 93.97 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.855 177.314 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.26 -49.4 77.22 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.934 179.159 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 68.8 mt -64.95 -35.76 76.16 Favored 'Isoleucine or valine' 0 C--O 1.234 0.273 0 CA-C-O 121.229 0.538 . . . . 0.0 110.35 178.477 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 74.0 t80 -57.88 -63.14 1.35 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.875 -179.078 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -68.96 -29.27 67.46 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.914 -173.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 64.9 tttm -94.93 -17.22 22.19 Favored 'General case' 0 C--O 1.237 0.423 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -172.704 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 99.2 m-85 -133.29 -52.16 0.89 Allowed 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 112.311 0.485 . . . . 0.0 112.311 -177.185 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 50.3 mm -67.03 -44.11 88.53 Favored 'Isoleucine or valine' 0 C--O 1.238 0.45 0 CA-C-O 120.886 0.374 . . . . 0.0 111.417 -172.048 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.465 ' HG3' ' H ' ' A' ' 74' ' ' ASP . 6.3 tp-100 -72.12 145.17 48.32 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.889 -174.624 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.422 ' O ' HG22 ' A' ' 73' ' ' THR . 13.2 m -85.78 27.45 0.86 Allowed 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 121.952 0.882 . . . . 0.0 110.36 178.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . 0.465 ' H ' ' HG3' ' A' ' 72' ' ' GLN . 13.9 m-20 -128.83 20.96 5.94 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 174.018 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -86.33 159.38 53.49 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 114.988 -1.006 . . . . 0.0 111.837 -171.139 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_endo -85.65 11.63 3.29 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.964 2.443 . . . . 0.0 111.973 177.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.661 ' HE2' ' HA ' ' A' ' 77' ' ' LYS . 0.4 OUTLIER -128.57 -44.41 1.37 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.242 178.394 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 64.52 97.63 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.581 178.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 58.2 t -101.3 134.18 42.33 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.271 177.163 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 38.5 m-80 -83.48 27.32 0.61 Allowed 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.538 -176.182 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 9.4 tp -57.45 143.28 41.02 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.552 174.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -46.69 128.64 10.8 Favored 'General case' 0 C--O 1.237 0.446 0 O-C-N 123.892 0.745 . . . . 0.0 111.7 -175.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -59.22 -45.75 90.28 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.196 -175.046 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . 0.478 ' O ' ' HB3' ' A' ' 87' ' ' GLU . 54.0 t60 -61.15 -29.63 69.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.898 179.662 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 28.2 m -71.34 -49.41 42.74 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.746 179.075 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.528 ' O ' HG23 ' A' ' 90' ' ' THR . 17.8 ptpt -66.95 -23.22 65.93 Favored 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 120.816 -0.353 . . . . 0.0 110.081 179.769 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.478 ' HB3' ' O ' ' A' ' 84' ' ' HIS . 41.1 tt0 -58.29 -53.09 62.19 Favored 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 171.196 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 58.5 t -58.88 -41.22 82.28 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.335 176.556 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 69.3 mt -60.41 -43.94 95.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.233 -179.515 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.528 HG23 ' O ' ' A' ' 86' ' ' LYS . 76.4 p -61.9 -31.68 72.0 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.214 0.53 . . . . 0.0 110.147 178.904 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . 0.484 HD22 ' N ' ' A' ' 91' ' ' ASN . 0.9 OUTLIER -79.95 -16.94 54.23 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.209 179.165 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 20.3 m -108.79 -14.24 14.63 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -176.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.0 tp -64.49 -21.61 29.51 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -170.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 7.7 t -57.01 -44.99 83.34 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 120.999 0.428 . . . . 0.0 110.368 177.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 -149.64 80.77 7.41 Favored Pre-proline 0 C--O 1.238 0.47 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 178.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . 0.525 ' HG2' HG22 ' A' ' 59' ' ' ILE . 74.1 Cg_endo -75.42 -161.67 0.13 Allowed 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 123.058 2.505 . . . . 0.0 112.591 -176.368 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 9.4 m -152.49 165.73 34.18 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.671 -176.198 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -47.32 -60.72 2.31 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 122.644 0.378 . . . . 0.0 111.489 -177.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' HIS . . . . . 0.464 ' ND1' ' HD2' ' A' ' 51' ' ' LYS . 77.0 m-70 -95.32 24.54 4.98 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.548 -0.297 . . . . 0.0 111.51 -177.085 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 41.4 t -66.24 -40.15 90.05 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.268 0.556 . . . . 0.0 109.724 176.356 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 81.7 m-85 -88.02 6.91 33.75 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.911 179.1 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . 0.511 ' O ' ' HB3' ' A' ' 105' ' ' GLN . 9.5 t70 -70.54 -33.88 71.64 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 178.255 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.581 ' O ' ' HG2' ' A' ' 107' ' ' ARG . . . -61.99 -42.51 99.23 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.629 173.561 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.05 -41.03 86.9 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.064 176.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.511 ' HB3' ' O ' ' A' ' 102' ' ' ASP . 25.4 tt0 -53.24 -53.94 43.43 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.954 174.232 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 42.7 t -51.72 -44.98 63.41 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.253 -177.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . 0.581 ' HG2' ' O ' ' A' ' 103' ' ' ALA . 19.9 mmm180 -62.8 -50.72 69.88 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 120.937 0.398 . . . . 0.0 111.076 -175.49 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 90.7 t -71.52 -42.76 72.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.925 -177.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 59.8 t80 -58.12 -53.21 60.8 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.525 179.606 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . 0.534 ' O ' ' HG2' ' A' ' 114' ' ' GLN . 0.0 OUTLIER -64.98 -32.05 73.59 Favored 'General case' 0 N--CA 1.461 0.091 0 N-CA-C 110.159 -0.312 . . . . 0.0 110.159 -178.994 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 58.2 tp -62.14 -62.32 1.86 Allowed 'General case' 0 N--CA 1.46 0.053 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.549 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . 0.471 ' O ' ' HB3' ' A' ' 116' ' ' SER . 25.4 ptt? -67.72 -21.55 65.29 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-O 120.747 0.308 . . . . 0.0 110.43 -178.443 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . 0.528 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 42.6 tt0 -64.22 -55.55 20.79 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 174.723 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . 0.534 ' HG2' ' O ' ' A' ' 110' ' ' GLN . 12.6 pt20 -77.5 -18.43 57.08 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.774 -177.046 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -114.96 3.9 14.64 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 -175.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . 0.471 ' HB3' ' O ' ' A' ' 112' ' ' MET . 32.2 t -147.03 -43.53 0.18 Allowed 'General case' 0 N--CA 1.466 0.339 0 O-C-N 122.068 -0.395 . . . . 0.0 111.442 177.726 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . 0.528 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 32.4 t80 -65.93 -40.3 91.29 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 120.913 0.387 . . . . 0.0 110.579 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 29.9 p -56.73 -55.01 39.67 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-O 121.665 0.745 . . . . 0.0 110.035 174.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . 0.434 HH12 ' CD ' ' A' ' 35' ' ' GLU . 27.1 mtp180 -58.2 -35.34 71.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 114.881 -1.054 . . . . 0.0 110.863 176.558 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 79.4 t80 -60.71 -45.3 94.77 Favored 'General case' 0 C--O 1.224 -0.282 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 179.618 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 87.4 mt -63.67 -23.58 67.43 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.954 0.407 . . . . 0.0 110.471 177.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -101.43 0.77 37.44 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.17 -0.468 . . . . 0.0 112.255 179.054 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 76.6 p -76.58 147.08 37.89 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 120.627 0.251 . . . . 0.0 110.513 -176.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -58.21 -31.17 67.08 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 175.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 43.7 mm -56.69 -48.94 79.99 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 CA-C-N 115.144 -0.935 . . . . 0.0 110.631 175.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' TYR . . . . . 0.424 ' O ' ' HG2' ' A' ' 130' ' ' MET . 88.4 t80 -66.43 -43.66 85.04 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.572 -179.252 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -62.14 -34.12 75.76 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.408 178.114 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -64.36 -35.24 80.25 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.061 175.023 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 99.6 mt -76.53 -25.69 54.41 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.84 177.328 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' MET . . . . . 0.424 ' HG2' ' O ' ' A' ' 126' ' ' TYR . 12.7 mmt . . . . . 0 N--CA 1.464 0.269 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.338 178.254 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.516 HG21 ' CZ2' ' A' ' 11' ' ' TRP . 8.9 p . . . . . 0 CA--C 1.534 0.328 0 CA-C-O 120.926 0.393 . . . . 0.0 111.264 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.4 m -91.9 148.81 37.79 Favored Pre-proline 0 CA--C 1.534 0.362 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.059 177.067 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -50.38 -36.49 48.19 Favored 'Trans proline' 0 C--N 1.353 0.768 0 C-N-CA 123.078 2.518 . . . . 0.0 113.007 -176.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.566 ' O ' HG22 ' A' ' 9' ' ' VAL . 1.0 OUTLIER -65.65 -41.07 92.99 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 121.473 0.654 . . . . 0.0 110.029 179.844 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.521 ' O ' ' HB2' ' A' ' 10' ' ' LYS . 2.6 tm-20 -69.64 -30.27 67.93 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 178.283 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.83 -44.54 80.86 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.067 178.431 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.669 HG12 ' SD ' ' A' ' 130' ' ' MET . 17.5 m -66.3 -26.07 37.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 CA-C-O 120.942 0.401 . . . . 0.0 110.39 179.495 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.53 ' O ' ' HG2' ' A' ' 13' ' ' GLU . 41.5 mmtm -57.89 -34.56 69.93 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.984 175.038 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.516 ' CZ2' HG21 ' A' ' 3' ' ' VAL . 43.1 m0 -60.08 -32.43 70.95 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 120.871 0.367 . . . . 0.0 110.946 -179.142 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -65.19 -3.15 10.88 Favored Glycine 0 CA--C 1.521 0.448 0 CA-C-N 115.667 -0.697 . . . . 0.0 114.477 -171.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.53 ' HG2' ' O ' ' A' ' 10' ' ' LYS . 13.4 pt-20 -91.35 -32.52 15.65 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 117.68 0.74 . . . . 0.0 110.897 179.406 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 51.8 m -150.37 123.58 8.89 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.022 -174.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.479 ' HZ ' ' SD ' ' A' ' 112' ' ' MET . 17.9 t80 -58.92 -32.48 69.6 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.984 176.55 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -54.46 -43.73 71.94 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.904 175.253 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -67.59 -42.58 82.26 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.343 179.103 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 68.2 tp -54.44 -38.98 66.93 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.17 177.199 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 53.1 tp -75.11 -28.4 60.21 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.027 179.407 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 38.4 m -68.23 -36.18 79.1 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.258 -177.396 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -86.77 121.5 29.36 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 179.748 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.6 ptm180 -58.08 -28.21 64.36 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.118 0.485 . . . . 0.0 110.292 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -61.75 -49.6 75.76 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.36 174.402 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -63.68 -44.67 96.04 Favored Glycine 0 C--N 1.335 0.492 0 CA-C-N 115.018 -0.992 . . . . 0.0 111.778 179.447 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 15.3 tp -48.7 -60.39 2.76 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 123.018 0.527 . . . . 0.0 111.072 177.314 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.478 ' O ' ' HB2' ' A' ' 30' ' ' ARG . 11.1 tp10 -59.01 -50.01 75.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.874 -175.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -60.68 -35.13 75.51 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 121.053 0.454 . . . . 0.0 111.106 -179.084 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 91.9 t80 -75.08 -46.3 35.59 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.861 -176.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.58 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 11.9 t -70.75 -27.8 64.22 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 -176.164 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.478 ' HB2' ' O ' ' A' ' 26' ' ' GLU . 0.2 OUTLIER -61.83 -54.73 38.14 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.191 -0.913 . . . . 0.0 109.863 177.714 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.49 ' O ' ' HB ' ' A' ' 34' ' ' THR . 86.9 t80 -57.62 -34.06 68.9 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.178 0.513 . . . . 0.0 110.653 -179.087 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 26.7 tp -74.81 -45.99 39.81 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.947 -178.242 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.58 ' HG3' ' O ' ' A' ' 29' ' ' THR . 68.3 mttm -60.95 -25.4 66.79 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.232 0.539 . . . . 0.0 110.002 177.211 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.49 ' HB ' ' O ' ' A' ' 31' ' ' PHE . 96.4 m -60.77 -35.31 76.09 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.263 177.691 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -101.89 9.78 40.34 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 120.986 0.422 . . . . 0.0 110.481 176.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 83.6 m-85 66.23 8.26 5.45 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.478 -0.783 . . . . 0.0 112.572 173.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 21.4 t -92.81 43.33 1.12 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.191 0.52 . . . . 0.0 109.751 -178.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -86.4 2.03 49.11 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.746 -174.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.35 -31.57 72.83 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -175.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.47 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 6.2 p30 -69.25 -57.99 4.63 Favored 'General case' 0 C--O 1.246 0.88 0 N-CA-C 111.969 0.359 . . . . 0.0 111.969 -176.38 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.517 ' HA ' ' HE1' ' A' ' 112' ' ' MET . 13.8 tt -63.0 -46.81 95.36 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-O 120.574 0.226 . . . . 0.0 110.477 -177.184 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -62.99 -24.5 67.94 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.066 177.681 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.47 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 82.9 t80 -62.75 -63.2 1.28 Allowed 'General case' 0 C--O 1.235 0.312 0 C-N-CA 121.399 -0.121 . . . . 0.0 111.022 179.552 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.605 ' HE1' ' HE3' ' A' ' 112' ' ' MET . 20.9 p-90 -70.97 -19.86 62.5 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 119.439 -0.904 . . . . 0.0 111.468 -175.146 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.419 HG13 ' O ' ' A' ' 41' ' ' ILE . 66.3 mt -67.33 -51.05 56.84 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 CA-C-O 121.293 0.568 . . . . 0.0 109.786 170.846 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.39 -28.6 69.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.514 178.693 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.625 ' SG ' ' HB2' ' A' ' 101' ' ' PHE . 41.0 t -68.58 -33.43 74.05 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.583 -179.722 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.731 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 10.5 pt-20 -83.29 -25.69 31.33 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 120.444 -0.503 . . . . 0.0 110.318 176.661 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.465 ' HA ' ' HE3' ' A' ' 52' ' ' LYS . 18.1 t70 -62.57 -33.37 74.82 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 168.81 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -71.62 -56.12 6.45 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 114.632 -1.167 . . . . 0.0 111.121 174.599 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.731 ' HG2' ' HA ' ' A' ' 48' ' ' GLU . 25.4 pttm -85.03 11.49 9.47 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -171.4 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.465 ' HE3' ' HA ' ' A' ' 49' ' ' ASP . 18.5 ptpt -88.67 -24.19 22.82 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 168.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.4 ' HB2' ' HG2' ' A' ' 58' ' ' GLN . 17.3 p -90.25 122.03 32.81 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 174.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -100.13 6.16 44.89 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.623 -172.259 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . 0.448 ' O ' HG12 ' A' ' 59' ' ' ILE . . . -67.09 123.03 20.59 Favored Glycine 0 CA--C 1.519 0.309 0 C-N-CA 121.015 -0.612 . . . . 0.0 112.013 179.187 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.467 ' O ' ' HD2' ' A' ' 60' ' ' HIS . 12.2 Cg_endo -54.05 -46.91 30.12 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.671 2.248 . . . . 0.0 112.067 -177.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 82.0 mm-40 -64.29 -40.52 96.13 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 121.346 0.593 . . . . 0.0 109.845 178.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.462 ' OE1' HD11 ' A' ' 61' ' ' LEU . 6.5 tp-100 -58.66 -43.29 89.82 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 114.829 -1.078 . . . . 0.0 110.557 -179.116 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.448 HG12 ' O ' ' A' ' 55' ' ' GLY . 42.3 mm -57.29 -49.5 79.75 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.212 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.809 -178.055 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.467 ' HD2' ' O ' ' A' ' 56' ' ' PRO . 74.8 m-70 -64.45 -54.3 34.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.596 -0.275 . . . . 0.0 111.563 -173.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.516 HD12 ' N ' ' A' ' 62' ' ' LYS . 4.2 pp -64.48 -31.83 73.21 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.624 0.249 . . . . 0.0 111.648 -175.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.516 ' N ' HD12 ' A' ' 61' ' ' LEU . 36.3 mmtm -71.49 -53.16 14.82 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 120.629 0.252 . . . . 0.0 110.544 176.414 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.69 -38.08 74.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.885 -178.626 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 27.6 tptp -65.49 -41.26 93.46 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.232 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -64.84 -50.81 65.21 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.687 178.463 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 70.6 mt -58.58 -36.56 60.26 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.206 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.198 178.42 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.473 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 91.6 t80 -56.01 -63.65 1.11 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.674 178.327 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -64.4 -35.34 80.6 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.752 -0.658 . . . . 0.0 112.04 -174.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 80.9 tttt -90.32 -25.84 20.29 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -170.195 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -127.15 -48.36 1.46 Allowed 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -174.272 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.473 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 48.4 mm -70.56 -38.37 73.24 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 CA-C-O 120.947 0.403 . . . . 0.0 111.19 -173.396 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.503 ' HB3' ' HB2' ' A' ' 75' ' ' ALA . 6.2 tp-100 -61.04 141.37 57.44 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.106 -176.402 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 28.8 m -73.59 -35.06 65.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.237 0.541 . . . . 0.0 110.73 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -93.68 27.66 2.6 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.206 0.527 . . . . 0.0 110.501 175.098 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.503 ' HB2' ' HB3' ' A' ' 72' ' ' GLN . . . -70.93 160.64 81.67 Favored Pre-proline 0 C--O 1.235 0.341 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.49 176.489 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.481 ' HD2' ' HB1' ' A' ' 75' ' ' ALA . 12.2 Cg_endo -55.1 -35.03 89.58 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.799 2.332 . . . . 0.0 112.268 -179.097 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.427 ' O ' ' HB3' ' A' ' 78' ' ' GLU . 33.6 mtmm -122.95 -50.27 1.94 Allowed 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.826 176.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.427 ' HB3' ' O ' ' A' ' 77' ' ' LYS . 44.0 tt0 68.9 139.81 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.375 0 O-C-N 123.698 0.623 . . . . 0.0 110.803 -175.132 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.415 ' C ' ' H ' ' A' ' 81' ' ' LEU . 60.8 t -95.44 149.15 4.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.427 175.495 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 41.8 m-80 -70.68 17.24 0.07 Allowed 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 -177.642 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.575 HD11 HG21 ' A' ' 85' ' ' THR . 47.4 tp -60.97 144.07 53.96 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 122.746 0.418 . . . . 0.0 110.822 176.647 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -54.92 143.38 26.33 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.744 -177.054 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.448 ' HA ' ' HG2' ' A' ' 86' ' ' LYS . 89.9 t80 -62.23 -44.7 95.96 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.872 -178.673 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . 0.416 ' O ' HG23 ' A' ' 88' ' ' VAL . 82.0 t60 -66.87 -30.31 70.44 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.567 0.222 . . . . 0.0 110.749 -178.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.575 HG21 HD11 ' A' ' 81' ' ' LEU . 27.1 m -69.29 -48.18 62.37 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 177.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.513 ' O ' HG23 ' A' ' 90' ' ' THR . 19.0 ptpt -65.97 -28.36 68.84 Favored 'General case' 0 N--CA 1.462 0.129 0 N-CA-C 109.754 -0.462 . . . . 0.0 109.754 178.011 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -60.18 -49.31 78.12 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.148 177.704 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.416 HG23 ' O ' ' A' ' 84' ' ' HIS . 58.3 t -56.4 -40.82 69.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 121.253 0.549 . . . . 0.0 109.678 176.209 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 72.3 mt -63.9 -42.62 96.41 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.968 178.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.513 HG23 ' O ' ' A' ' 86' ' ' LYS . 67.9 p -62.61 -25.35 68.05 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.891 0.377 . . . . 0.0 110.9 -178.126 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 57.4 m-80 -90.59 -23.74 20.76 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.252 178.615 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 31.1 t -98.22 -9.64 25.31 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.63 -176.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 9.4 tp -60.89 -26.14 37.81 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 N-CA-C 112.003 0.371 . . . . 0.0 112.003 -174.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 12.3 t -68.57 -24.41 64.6 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 120.83 0.348 . . . . 0.0 110.791 -179.191 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -144.68 76.05 14.34 Favored Pre-proline 0 CA--C 1.532 0.268 0 CA-C-N 116.213 -0.448 . . . . 0.0 109.907 179.466 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -82.3 153.22 16.12 Favored 'Trans proline' 0 C--O 1.237 0.45 0 C-N-CA 122.671 2.247 . . . . 0.0 112.484 -178.118 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 47.8 p -111.3 174.09 6.03 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.228 176.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 34.7 tp -57.78 -57.27 13.49 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.371 0.605 . . . . 0.0 111.111 -178.297 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' HIS . . . . . 0.42 ' ND1' ' HB3' ' A' ' 102' ' ' ASP . 1.2 t-80 -95.85 12.65 29.42 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.326 -171.861 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 22.7 p -44.26 -47.42 9.4 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -172.312 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.625 ' HB2' ' SG ' ' A' ' 47' ' ' CYS . 99.0 m-85 -78.85 11.61 2.56 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.244 0.831 . . . . 0.0 113.244 -171.892 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . 0.455 ' HA ' ' HG2' ' A' ' 105' ' ' GLN . 8.6 p30 -60.47 -38.68 85.03 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 118.189 0.45 . . . . 0.0 111.545 -177.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.07 -38.76 83.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.191 0.519 . . . . 0.0 110.372 176.021 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.8 -36.16 79.92 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.801 -179.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.49 ' HG2' ' O ' ' A' ' 101' ' ' PHE . 13.0 mm-40 -56.87 -49.17 76.31 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.308 0.575 . . . . 0.0 109.569 179.822 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 45.2 t -59.12 -49.11 79.14 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.04 -0.982 . . . . 0.0 110.923 -179.024 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 28.1 mmm180 -59.46 -47.33 85.9 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.242 -177.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.432 HG21 ' CD2' ' A' ' 43' ' ' PHE . 88.6 t -66.61 -41.54 88.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.156 -178.623 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 65.1 t80 -64.86 -43.43 93.0 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.361 -177.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 5.3 pp0? -69.58 -37.25 76.87 Favored 'General case' 0 C--O 1.239 0.512 0 N-CA-C 111.535 0.198 . . . . 0.0 111.535 -175.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 4.5 pp -73.58 -24.84 60.13 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-O 120.836 0.35 . . . . 0.0 110.2 179.23 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . 0.605 ' HE3' ' HE1' ' A' ' 44' ' ' TRP . 34.4 ttm -66.38 -50.17 64.39 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.771 -0.65 . . . . 0.0 109.997 175.136 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . 0.573 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 38.2 tt0 -54.88 -57.86 9.91 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.081 -178.127 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -60.88 -9.38 4.08 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 112.963 0.727 . . . . 0.0 112.963 -172.028 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . 0.456 ' O ' ' HG3' ' A' ' 119' ' ' ARG . 32.9 t70 -126.93 -68.85 0.78 Allowed 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 120.61 0.243 . . . . 0.0 111.087 178.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 22.7 t -60.96 -38.38 85.69 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 111.697 0.258 . . . . 0.0 111.697 -175.768 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . 0.573 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 42.0 t80 -71.52 -40.78 69.88 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 120.722 0.296 . . . . 0.0 110.706 -177.261 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 34.5 p -65.93 -43.73 87.23 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 109.905 -0.405 . . . . 0.0 109.905 177.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . 0.456 ' HG3' ' O ' ' A' ' 115' ' ' ASP . 90.2 mtt180 -55.66 -44.1 76.91 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.135 174.213 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -58.95 -41.98 88.76 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.299 179.188 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 83.6 mt -70.88 -14.86 62.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.811 0.338 . . . . 0.0 111.113 179.134 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . 0.623 ' HA ' ' HE3' ' A' ' 122' ' ' LYS . 0.0 OUTLIER -113.88 7.48 17.0 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.601 179.326 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 97.0 p -84.42 148.95 26.31 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 120.624 0.25 . . . . 0.0 111.041 -179.412 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -60.15 -29.92 68.97 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 174.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 42.0 mm -55.12 -57.09 8.06 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-N 115.261 -0.881 . . . . 0.0 111.167 178.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' TYR . . . . . 0.463 ' O ' ' HG2' ' A' ' 130' ' ' MET . 31.7 t80 -66.22 -38.75 88.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.909 0.385 . . . . 0.0 110.324 -178.236 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 92.1 mt -65.27 -28.57 69.43 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.599 178.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -71.9 -37.56 70.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.001 178.194 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 81.0 mt -64.6 -31.84 73.23 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.964 176.352 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' MET . . . . . 0.669 ' SD ' HG12 ' A' ' 9' ' ' VAL . 26.2 mmt . . . . . 0 C--O 1.232 0.181 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.769 176.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.475 HG12 HD22 ' A' ' 129' ' ' LEU . 14.7 p . . . . . 0 C--O 1.235 0.313 0 CA-C-O 121.091 0.472 . . . . 0.0 111.901 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 29.5 m -95.58 149.24 35.82 Favored Pre-proline 0 CA--C 1.535 0.372 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.434 173.155 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -44.21 -46.39 11.47 Favored 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 123.623 2.882 . . . . 0.0 113.793 -173.056 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.641 ' O ' HG22 ' A' ' 9' ' ' VAL . 33.9 tt0 -61.78 -47.7 83.96 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 120.696 0.284 . . . . 0.0 111.178 -175.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -64.35 -34.96 79.35 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.109 0.48 . . . . 0.0 109.889 178.235 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.61 -38.29 89.64 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.235 -179.605 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.641 HG22 ' O ' ' A' ' 6' ' ' GLU . 11.4 m -75.15 -25.89 18.55 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 C-N-CA 120.92 -0.312 . . . . 0.0 110.63 179.833 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.554 ' HG2' ' O ' ' A' ' 6' ' ' GLU . 74.8 mmtt -60.35 -34.48 73.9 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.008 0.432 . . . . 0.0 110.268 176.86 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.416 ' CE3' HD13 ' A' ' 18' ' ' LEU . 49.1 m0 -61.72 -22.37 65.31 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.802 179.451 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -64.61 -13.03 54.73 Favored Glycine 0 CA--C 1.519 0.31 0 CA-C-N 115.848 -0.614 . . . . 0.0 113.072 -178.098 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.527 ' HG2' ' O ' ' A' ' 10' ' ' LYS . 10.7 pt-20 -79.89 -23.19 42.01 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 117.029 0.415 . . . . 0.0 110.739 179.78 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 31.6 t -171.0 132.01 0.83 Allowed 'General case' 0 C--O 1.238 0.469 0 CA-C-O 121.377 0.608 . . . . 0.0 111.716 -177.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 28.6 t80 -60.86 -29.04 69.29 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.861 174.385 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -55.85 -43.79 77.39 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.508 175.555 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 33.3 ttmt -66.96 -40.49 87.5 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.479 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.416 HD13 ' CE3' ' A' ' 11' ' ' TRP . 39.1 tp -59.23 -40.5 86.1 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.149 0.499 . . . . 0.0 110.311 175.514 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 39.6 tp -73.86 -36.67 64.86 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.341 -176.429 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 24.6 p -79.56 -23.26 42.92 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.583 -177.017 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.71 114.45 13.15 Favored 'General case' 0 C--O 1.223 -0.304 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 177.193 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.514 ' HD2' ' H ' ' A' ' 22' ' ' ARG . 4.2 mpt_? -56.18 -42.32 76.89 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 120.902 0.382 . . . . 0.0 111.167 -170.709 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -70.18 -33.05 71.27 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.693 176.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -64.72 -54.19 30.13 Favored Glycine 0 C--N 1.332 0.357 0 N-CA-C 111.397 -0.681 . . . . 0.0 111.397 177.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.9 tt -54.63 -40.0 68.53 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 123.085 0.554 . . . . 0.0 110.308 174.736 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -60.87 -42.83 98.68 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-O 121.059 0.456 . . . . 0.0 110.305 177.73 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -68.87 -36.88 78.62 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.202 0.525 . . . . 0.0 110.516 178.158 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 77.3 t80 -70.32 -43.22 70.75 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.712 -175.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.584 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 7.2 t -64.85 -44.04 91.05 Favored 'General case' 0 C--N 1.333 -0.137 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 178.658 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 87.7 mtm180 -57.85 -27.76 63.51 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-O 121.047 0.451 . . . . 0.0 110.651 178.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.522 ' O ' HG22 ' A' ' 34' ' ' THR . 75.9 t80 -83.32 -41.17 18.55 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.779 175.036 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 17.5 tp -76.62 -21.26 55.77 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.744 -171.483 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.584 ' HG3' ' O ' ' A' ' 29' ' ' THR . 68.5 mttm -61.68 -30.51 70.78 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.343 -178.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.522 HG22 ' O ' ' A' ' 31' ' ' PHE . 9.6 t -65.37 -31.0 71.89 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.077 -175.601 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -102.3 8.05 40.46 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 120.916 0.388 . . . . 0.0 110.79 179.41 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 88.9 m-85 59.79 20.05 8.87 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.897 174.435 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 33.0 t -85.59 1.06 50.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.197 0.522 . . . . 0.0 110.348 -177.429 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 52.1 tt0 -58.91 -30.85 68.12 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.283 -179.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -60.74 -24.16 65.49 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.136 179.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.522 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 93.6 m-20 -68.21 -39.96 82.25 Favored 'General case' 0 C--O 1.238 0.459 0 CA-C-O 121.405 0.621 . . . . 0.0 109.424 174.689 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.4 ' O ' HG13 ' A' ' 45' ' ' ILE . 46.0 mt -63.47 -49.73 81.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.422 173.88 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.444 ' HA ' ' HB ' ' A' ' 45' ' ' ILE . 49.9 mt-10 -60.85 -27.21 67.93 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.891 178.273 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.522 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 62.5 t80 -58.67 -62.61 1.73 Allowed 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.302 176.694 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.526 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 16.0 p-90 -74.91 -14.61 60.67 Favored 'General case' 0 CA--C 1.528 0.1 0 C-N-CA 119.66 -0.816 . . . . 0.0 111.442 -177.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.444 ' HB ' ' HA ' ' A' ' 42' ' ' GLU . 15.6 mt -61.9 -47.11 94.74 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 167.797 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.83 -30.15 70.27 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.275 177.074 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.419 ' HB3' ' HA ' ' A' ' 44' ' ' TRP . 25.6 t -62.71 -46.28 88.84 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.455 175.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.526 ' HG2' ' O ' ' A' ' 44' ' ' TRP . 26.7 mm-40 -64.35 -35.09 79.75 Favored 'General case' 0 C--N 1.333 -0.134 0 N-CA-C 110.133 -0.321 . . . . 0.0 110.133 178.534 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.421 ' HA ' ' HE2' ' A' ' 52' ' ' LYS . 1.3 m-20 -57.61 -47.54 81.88 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 173.234 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.418 ' CZ ' HG23 ' A' ' 59' ' ' ILE . 57.8 t80 -59.73 -39.05 83.43 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.457 177.04 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.441 ' HG2' ' HA ' ' A' ' 99' ' ' HIS . 53.3 mtpt -72.82 -26.61 61.56 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.807 -177.819 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.459 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 65.1 pttt -105.04 -1.89 25.09 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 111.614 0.227 . . . . 0.0 111.614 -178.329 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 35.6 p -79.37 135.48 36.72 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 110.308 -0.256 . . . . 0.0 110.308 177.531 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.68 154.75 20.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.975 0.417 . . . . 0.0 110.499 -179.828 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 99.58 110.83 3.17 Favored Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 111.115 -0.794 . . . . 0.0 111.115 -176.31 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -51.55 -38.88 65.58 Favored 'Trans proline' 0 C--N 1.352 0.736 0 C-N-CA 122.9 2.4 . . . . 0.0 111.851 -177.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 -54.54 -49.89 69.23 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.119 178.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 8.5 tp-100 -58.16 -43.49 87.43 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.15 -0.932 . . . . 0.0 110.016 -179.502 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.418 HG23 ' CZ ' ' A' ' 50' ' ' PHE . 46.7 mm -60.88 -46.82 95.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.505 -178.79 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.447 ' O ' ' HG2' ' A' ' 64' ' ' LYS . 12.3 m170 -62.7 -48.14 80.57 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.358 -174.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.587 HD12 ' N ' ' A' ' 62' ' ' LYS . 3.6 pp -72.48 -38.05 68.28 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.47 -176.644 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.587 ' N ' HD12 ' A' ' 61' ' ' LEU . 28.7 mmtp -64.76 -38.68 91.79 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.786 0.327 . . . . 0.0 110.566 177.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.04 -47.61 77.55 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.499 177.014 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.447 ' HG2' ' O ' ' A' ' 60' ' ' HIS . 48.3 mmtm -62.62 -40.79 98.06 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.898 -179.429 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.83 -55.61 28.06 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.355 -178.404 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 68.0 mt -60.99 -35.99 69.09 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 CA-C-O 121.296 0.57 . . . . 0.0 110.244 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.528 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 79.7 t80 -59.2 -67.99 0.32 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.152 -179.432 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -61.51 -31.52 71.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.254 -0.43 . . . . 0.0 112.013 -173.558 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.42 ' HE3' ' CE2' ' A' ' 70' ' ' PHE . 36.4 ttpt -83.03 -32.26 26.98 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.225 0.454 . . . . 0.0 112.225 -172.699 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . 0.42 ' CE2' ' HE3' ' A' ' 69' ' ' LYS . 51.2 m-85 -131.98 -46.87 0.94 Allowed 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 112.894 0.702 . . . . 0.0 112.894 -174.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.528 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 47.7 mm -68.95 -37.14 76.9 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 CA-C-O 120.749 0.309 . . . . 0.0 111.581 -173.215 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.761 ' HG3' ' H ' ' A' ' 74' ' ' ASP . 6.4 tp-100 -57.98 138.29 56.03 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.868 -176.513 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 15.3 m -79.92 9.3 5.5 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.747 0.784 . . . . 0.0 110.708 -179.202 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . 0.761 ' H ' ' HG3' ' A' ' 72' ' ' GLN . 22.0 m-20 -132.9 25.23 4.3 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.245 -0.888 . . . . 0.0 108.744 172.204 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.78 156.02 92.57 Favored Pre-proline 0 CA--C 1.531 0.225 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.031 -178.2 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -62.17 -23.93 75.87 Favored 'Trans proline' 0 C--N 1.35 0.619 0 C-N-CA 122.702 2.268 . . . . 0.0 112.762 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 30.9 mmtp -115.57 -56.84 2.3 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.312 179.167 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 65.8 114.77 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.372 0 O-C-N 123.671 0.607 . . . . 0.0 110.983 -173.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.441 ' O ' HG12 ' A' ' 79' ' ' VAL . 10.6 t -91.88 25.6 0.39 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 CA-C-O 121.118 0.485 . . . . 0.0 110.101 179.187 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 9.5 p30 43.01 27.97 0.12 Allowed 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.821 0.848 . . . . 0.0 112.388 179.277 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.481 HD11 HG21 ' A' ' 85' ' ' THR . 24.5 tp -56.79 145.45 29.3 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.635 -0.712 . . . . 0.0 111.94 -178.47 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -48.03 138.9 8.63 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.135 -0.939 . . . . 0.0 111.808 179.467 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.545 ' HA ' ' HD2' ' A' ' 86' ' ' LYS . 64.5 t80 -64.22 -41.52 96.98 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.826 -174.714 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 85.1 t60 -70.19 -29.5 66.38 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.863 0.363 . . . . 0.0 110.46 -178.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.481 HG21 HD11 ' A' ' 81' ' ' LEU . 25.9 m -69.17 -41.12 77.64 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 175.06 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.545 ' HD2' ' HA ' ' A' ' 83' ' ' PHE . 47.4 mttm -54.77 -46.77 74.45 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.504 171.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -52.19 -55.38 21.47 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 114.938 -1.028 . . . . 0.0 110.966 -179.001 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 61.9 t -55.06 -43.19 68.69 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 CA-C-O 121.176 0.513 . . . . 0.0 110.601 -179.317 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 74.3 mt -66.63 -41.63 88.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.949 -178.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 68.7 p -66.86 -18.89 65.6 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.0 0.428 . . . . 0.0 110.955 -179.241 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 79.8 m-20 -86.97 -31.6 20.53 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.046 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 22.3 p -107.17 -4.61 18.63 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -175.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 8.0 tp -54.3 -28.11 17.89 Favored 'Isoleucine or valine' 0 C--O 1.238 0.493 0 N-CA-C 112.003 0.372 . . . . 0.0 112.003 -174.707 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.497 HG23 ' HG2' ' A' ' 95' ' ' GLN . 3.4 t -55.1 -48.84 73.03 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.752 177.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.497 ' HG2' HG23 ' A' ' 94' ' ' THR . 21.8 pt20 -162.19 82.02 1.76 Allowed Pre-proline 0 CA--C 1.532 0.261 0 CA-C-O 121.282 0.563 . . . . 0.0 109.871 -177.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -85.26 167.23 10.68 Favored 'Trans proline' 0 CA--C 1.531 0.374 0 C-N-CA 123.012 2.475 . . . . 0.0 113.227 -174.332 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.441 HG22 ' H ' ' A' ' 98' ' ' LEU . 2.9 m -86.34 169.43 12.95 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.109 179.535 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.441 ' H ' HG22 ' A' ' 97' ' ' THR . 3.6 mm? -50.49 -49.41 55.51 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 122.883 0.473 . . . . 0.0 111.852 -176.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' HIS . . . . . 0.441 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 19.1 m-70 -100.82 33.02 2.93 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 120.86 0.362 . . . . 0.0 111.322 -175.813 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 25.2 p -64.74 -50.27 67.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.946 0.403 . . . . 0.0 110.946 179.053 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -78.59 6.15 9.37 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.528 -179.531 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -58.61 -36.67 74.41 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.163 0.506 . . . . 0.0 110.231 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.9 -44.35 91.21 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.454 174.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.58 -39.3 90.68 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.464 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.515 ' HG2' ' HB2' ' A' ' 44' ' ' TRP . 0.9 OUTLIER -57.48 -52.1 66.76 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 115.958 -0.564 . . . . 0.0 109.751 176.185 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 25.2 t -61.44 -38.3 86.7 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.847 -178.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . 0.571 ' O ' ' HG ' ' A' ' 111' ' ' LEU . 36.7 mmt180 -65.51 -57.1 9.06 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.441 -179.334 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.456 ' HA ' HD12 ' A' ' 111' ' ' LEU . 93.3 t -59.95 -40.58 83.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.892 0.377 . . . . 0.0 110.858 -177.856 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . 0.51 ' HA ' ' HE1' ' A' ' 112' ' ' MET . 3.6 t80 -56.0 -49.61 73.16 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.198 177.591 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . 0.526 ' HG2' ' O ' ' A' ' 107' ' ' ARG . 10.5 pt20 -72.51 -17.73 61.72 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.653 -0.249 . . . . 0.0 111.015 -176.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.571 ' HG ' ' O ' ' A' ' 107' ' ' ARG . 73.3 mt -68.39 -58.65 4.04 Favored 'General case' 0 C--O 1.235 0.312 0 O-C-N 123.189 0.305 . . . . 0.0 110.853 178.609 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . 0.51 ' HE1' ' HA ' ' A' ' 109' ' ' TYR . 0.1 OUTLIER -75.92 -14.41 60.26 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 120.132 -0.627 . . . . 0.0 110.342 -179.002 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . 0.598 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 39.3 tt0 -60.91 -61.35 2.64 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.145 0.498 . . . . 0.0 109.761 172.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -69.51 5.15 1.47 Allowed 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.816 -0.629 . . . . 0.0 112.595 -173.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -129.4 -66.27 0.82 Allowed 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 120.897 0.379 . . . . 0.0 111.302 176.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 7.4 m -72.64 -28.12 62.55 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.951 -172.276 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . 0.598 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 34.1 t80 -64.89 -46.97 79.51 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 121.219 -0.192 . . . . 0.0 110.691 -179.081 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 31.7 p -64.13 -43.34 95.58 Favored 'General case' 0 C--O 1.239 0.531 0 CA-C-O 121.131 0.491 . . . . 0.0 110.294 179.327 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 51.8 mtt180 -57.33 -42.85 82.71 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.124 175.283 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.423 ' O ' ' HB2' ' A' ' 126' ' ' TYR . 78.4 t80 -61.53 -42.7 99.21 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.385 179.369 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 90.1 mt -60.04 -32.76 71.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.587 -0.279 . . . . 0.0 111.612 -178.359 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . 0.726 ' HA ' ' HE2' ' A' ' 122' ' ' LYS . 10.0 mmpt? -110.73 11.49 22.62 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 111.998 0.37 . . . . 0.0 111.998 -179.331 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 79.4 p -74.48 156.55 36.8 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-O 120.797 0.332 . . . . 0.0 110.718 177.745 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -55.63 -30.29 60.71 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.152 175.319 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.478 ' N ' HD12 ' A' ' 125' ' ' ILE . 2.3 mp -63.09 -49.77 82.06 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.218 -178.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' TYR . . . . . 0.423 ' HB2' ' O ' ' A' ' 120' ' ' PHE . 71.0 t80 -65.63 -35.41 80.72 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.777 -177.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 88.7 mt -66.36 -34.84 78.88 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.914 0.388 . . . . 0.0 109.956 176.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -68.86 -33.26 73.51 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.844 -0.616 . . . . 0.0 109.79 175.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.475 HD22 HG12 ' A' ' 3' ' ' VAL . 88.6 mt -74.04 -32.66 63.43 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.386 176.104 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' MET . . . . . 0.431 ' HA ' ' CE ' ' A' ' 130' ' ' MET . 7.5 mmt . . . . . 0 CA--C 1.519 -0.246 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.687 176.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 2.6 p . . . . . 0 CA--C 1.53 0.206 0 CA-C-O 120.766 0.317 . . . . 0.0 110.459 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.6 m -61.74 141.66 94.99 Favored Pre-proline 0 CA--C 1.534 0.339 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.248 178.585 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -55.22 -35.39 90.99 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 122.564 2.176 . . . . 0.0 111.845 -179.65 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -65.48 -49.36 69.37 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 178.009 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -55.65 -44.32 77.09 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.112 176.524 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.34 -57.03 14.81 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.255 -178.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 26.5 m -64.03 -26.06 39.6 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 CA-C-O 120.826 0.346 . . . . 0.0 110.682 -179.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 16.3 tppt? -68.86 -30.16 68.62 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.499 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.453 ' HZ2' ' ND1' ' A' ' 21' ' ' HIS . 54.5 m0 -62.1 -31.52 71.98 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 121.058 0.456 . . . . 0.0 109.926 174.529 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -59.79 -16.44 38.54 Favored Glycine 0 C--N 1.335 0.508 0 CA-C-N 115.787 -0.642 . . . . 0.0 113.518 -175.056 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -116.77 3.86 12.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.624 0.249 . . . . 0.0 110.987 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 43.9 m -152.02 98.01 2.39 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 120.871 0.367 . . . . 0.0 111.136 -178.3 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 57.1 t80 -65.2 -36.0 82.82 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 121.313 0.578 . . . . 0.0 109.554 178.157 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -58.93 -32.84 69.93 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.278 -0.873 . . . . 0.0 110.325 177.347 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 22.9 ttmm -72.98 -39.17 66.31 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.0 -0.545 . . . . 0.0 109.86 -179.61 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.497 HD22 ' CE1' ' A' ' 117' ' ' TYR . 14.9 tp -56.18 -50.48 71.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.983 174.499 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 34.4 tp -70.55 -31.57 68.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.133 -0.939 . . . . 0.0 111.524 -175.22 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 38.6 p -81.4 -25.77 35.97 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 120.693 0.282 . . . . 0.0 111.113 -179.697 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.453 ' ND1' ' HZ2' ' A' ' 11' ' ' TRP . 23.8 t-80 -85.29 118.0 24.57 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 179.492 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 39.5 mtm180 -42.24 -54.88 3.52 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.08 0.552 . . . . 0.0 111.751 -177.193 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -57.14 -36.36 70.61 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.265 -179.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -71.98 -51.31 14.97 Favored Glycine 0 N--CA 1.451 -0.302 0 N-CA-C 111.674 -0.57 . . . . 0.0 111.674 -178.468 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 7.0 tt -54.03 -48.16 70.79 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.247 -0.476 . . . . 0.0 110.277 176.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -61.31 -51.23 69.73 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.632 -179.315 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -60.58 -41.62 95.01 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.326 -177.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 77.6 t80 -74.9 -42.17 58.33 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.178 -175.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.443 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 10.6 t -64.66 -43.5 93.42 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 120.966 -0.293 . . . . 0.0 110.418 -176.771 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.46 -33.04 74.32 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 121.073 0.463 . . . . 0.0 110.006 179.315 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.468 ' O ' HG22 ' A' ' 34' ' ' THR . 92.4 t80 -65.95 -48.99 69.51 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.499 178.686 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 19.5 tp -68.77 -26.16 65.08 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.102 0.477 . . . . 0.0 110.882 -175.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.543 ' HG2' ' HB3' ' A' ' 38' ' ' GLU . 68.4 mttm -85.26 -1.17 56.65 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.611 -179.419 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.468 HG22 ' O ' ' A' ' 31' ' ' PHE . 3.8 t -69.79 -33.34 72.25 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 120.937 0.398 . . . . 0.0 110.339 179.755 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -118.79 16.73 13.54 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.356 178.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 83.5 m-85 60.15 28.89 18.5 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 115.418 -0.81 . . . . 0.0 112.009 176.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 21.8 t -82.27 4.71 22.57 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 121.884 0.849 . . . . 0.0 108.779 174.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.543 ' HB3' ' HG2' ' A' ' 33' ' ' LYS . 13.7 pt-20 -56.42 -19.31 14.38 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 114.577 -1.192 . . . . 0.0 111.629 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.44 ' O ' ' HB2' ' A' ' 43' ' ' PHE . 10.1 mm-40 -45.77 -33.07 2.84 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.083 179.384 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.517 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 49.7 m-80 -72.63 -47.49 47.23 Favored 'General case' 0 C--O 1.24 0.581 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.552 -178.434 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.513 ' HA ' ' HE1' ' A' ' 112' ' ' MET . 13.6 tt -70.94 -45.41 73.15 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 -177.257 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.474 ' OE1' ' HB2' ' A' ' 38' ' ' GLU . 4.2 mp0 -63.26 -23.27 67.35 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.65 174.318 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.517 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 66.8 t80 -62.09 -60.85 3.0 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 120.471 0.176 . . . . 0.0 110.776 177.632 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.656 ' HB2' ' HG3' ' A' ' 105' ' ' GLN . 13.1 p-90 -72.92 -9.68 58.97 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 119.258 -0.977 . . . . 0.0 111.513 -177.58 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.409 HG13 ' O ' ' A' ' 41' ' ' ILE . 79.8 mt -79.82 -33.22 14.64 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 166.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.47 ' HA ' ' OD2' ' A' ' 49' ' ' ASP . . . -67.14 -21.62 65.81 Favored 'General case' 0 CA--C 1.522 -0.105 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.64 179.071 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 44.4 t -68.72 -32.82 72.89 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.731 172.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.529 ' O ' ' HG2' ' A' ' 51' ' ' LYS . 17.0 mm-40 -75.17 -49.25 20.06 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.316 179.646 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.51 ' HA ' ' HD3' ' A' ' 52' ' ' LYS . 3.1 p30 -70.32 -11.99 61.28 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.465 177.426 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 24.5 t80 -71.76 -49.2 41.09 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.371 174.201 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.529 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 13.1 ptmm? -62.38 -26.08 68.27 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.891 0.376 . . . . 0.0 109.998 176.855 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.51 ' HD3' ' HA ' ' A' ' 49' ' ' ASP . 51.1 mtpt -67.34 -31.44 71.7 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.674 175.22 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 31.6 m -82.32 51.26 1.77 Allowed 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 121.243 0.544 . . . . 0.0 109.81 178.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.77 16.83 0.08 Allowed 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 114.052 1.131 . . . . 0.0 114.052 -170.186 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . 0.491 ' O ' HG12 ' A' ' 59' ' ' ILE . . . -65.88 130.64 33.5 Favored Glycine 0 CA--C 1.523 0.569 0 C-N-CA 120.555 -0.831 . . . . 0.0 111.211 175.504 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -50.46 -43.93 42.09 Favored 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 123.058 2.505 . . . . 0.0 113.009 -173.664 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 22.0 tm0? -93.83 -33.15 13.66 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 179.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 25.5 tp60 -54.11 -35.6 62.33 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.958 179.391 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.491 HG12 ' O ' ' A' ' 55' ' ' GLY . 27.1 mm -52.77 -42.25 41.5 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.611 176.201 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 22.8 m-70 -65.63 -45.18 84.04 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.52 -177.466 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 91.0 mt -68.03 -43.65 78.28 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.011 -178.504 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.48 ' NZ ' HD11 ' A' ' 66' ' ' ILE . 8.0 tmtt? -66.35 -40.96 90.13 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.512 -177.105 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.9 -41.3 87.39 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.543 176.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 14.6 tppt? -53.69 -46.99 70.88 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.723 177.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.7 -59.68 4.66 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.579 179.235 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.48 HD11 ' NZ ' ' A' ' 62' ' ' LYS . 66.5 mt -56.73 -35.59 46.28 Favored 'Isoleucine or valine' 0 C--O 1.235 0.336 0 CA-C-O 121.37 0.605 . . . . 0.0 110.522 179.545 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.431 ' OH ' HG22 ' A' ' 90' ' ' THR . 83.1 t80 -62.8 -67.68 0.4 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.171 -176.803 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.505 ' HA ' ' HB2' ' A' ' 72' ' ' GLN . 29.1 mt-10 -77.43 -1.81 32.1 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 -172.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 65.8 tttp -100.57 -28.73 12.73 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 116.865 -0.152 . . . . 0.0 111.334 177.486 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . 0.438 ' HB3' HG23 ' A' ' 79' ' ' VAL . 75.0 m-85 -132.86 -43.98 0.88 Allowed 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -175.657 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 45.5 mm -77.0 -36.59 25.2 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 CA-C-O 120.698 0.285 . . . . 0.0 111.691 -173.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.505 ' HB2' ' HA ' ' A' ' 68' ' ' GLU . 60.0 tp60 -59.25 133.66 56.3 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.829 -175.194 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 37.1 p -61.95 124.06 19.74 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.017 177.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 26.9 t70 70.99 29.9 2.88 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.117 -178.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.442 ' HB1' ' HD2' ' A' ' 76' ' ' PRO . . . -63.65 164.91 13.71 Favored Pre-proline 0 CA--C 1.537 0.445 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.724 171.682 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.442 ' HD2' ' HB1' ' A' ' 75' ' ' ALA . 84.7 Cg_exo -45.18 -57.61 2.02 Favored 'Trans proline' 0 C--N 1.356 0.955 0 C-N-CA 122.499 2.133 . . . . 0.0 111.915 178.834 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.1 72.66 1.47 Allowed 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 171.736 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -68.05 146.76 53.2 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.184 -178.289 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.479 HG11 HG22 ' A' ' 108' ' ' VAL . 53.5 t -85.02 147.05 5.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 176.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 46.7 m-80 -77.86 51.8 0.98 Allowed 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 121.606 0.717 . . . . 0.0 110.151 177.723 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.407 HD11 HG21 ' A' ' 85' ' ' THR . 44.8 tp -73.79 147.22 43.62 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.001 -0.999 . . . . 0.0 110.351 178.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -50.34 139.98 14.24 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.431 178.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 47.8 p90 -64.79 -37.35 87.33 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.945 -176.26 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . 0.421 ' O ' ' HB3' ' A' ' 87' ' ' GLU . 72.4 t60 -69.16 -36.61 77.59 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.81 0.338 . . . . 0.0 110.379 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.407 HG21 HD11 ' A' ' 81' ' ' LEU . 38.7 m -66.86 -43.99 82.14 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.121 176.831 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.446 ' O ' HG23 ' A' ' 90' ' ' THR . 95.7 mttt -60.82 -38.56 85.85 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 174.831 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.421 ' HB3' ' O ' ' A' ' 84' ' ' HIS . 43.2 tt0 -56.52 -50.19 72.56 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.41 177.719 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.413 HG23 ' O ' ' A' ' 84' ' ' HIS . 96.2 t -62.42 -51.15 75.85 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.797 179.079 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 71.4 mt -57.73 -49.29 81.29 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.273 -176.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.446 HG23 ' O ' ' A' ' 86' ' ' LYS . 49.1 p -57.66 -39.98 78.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.166 0.507 . . . . 0.0 111.083 -178.473 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 32.9 m-80 -85.61 -4.87 59.28 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.983 -176.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 15.3 m -124.88 0.84 8.04 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.7 tp -66.63 -23.01 30.6 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 CA-C-O 120.761 0.315 . . . . 0.0 111.459 -174.006 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.554 HG23 ' HG2' ' A' ' 95' ' ' GLN . 15.4 t -63.03 -25.31 68.32 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.981 179.298 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.554 ' HG2' HG23 ' A' ' 94' ' ' THR . 11.4 pt20 -151.83 77.25 7.11 Favored Pre-proline 0 CA--C 1.536 0.412 0 CA-C-O 121.236 0.541 . . . . 0.0 110.503 179.596 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . 0.475 ' HG2' HG22 ' A' ' 59' ' ' ILE . 96.4 Cg_endo -88.69 159.31 6.32 Favored 'Trans proline' 0 N--CA 1.461 -0.418 0 C-N-CA 122.768 2.312 . . . . 0.0 112.214 179.134 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.485 ' H ' ' HB2' ' A' ' 100' ' ' SER . 18.5 p -96.3 172.28 8.05 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.938 176.355 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 10.4 mp -53.29 -30.32 38.07 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 -174.029 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -133.2 31.71 3.79 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.907 0.384 . . . . 0.0 110.513 -176.458 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . 0.485 ' HB2' ' H ' ' A' ' 97' ' ' THR . 23.5 t -54.68 -26.02 30.8 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.82 -177.321 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -83.68 17.9 2.11 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.438 -178.703 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -56.94 -50.13 73.53 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.917 0.389 . . . . 0.0 110.965 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.7 -47.97 83.53 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.671 179.074 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.404 ' O ' HG23 ' A' ' 108' ' ' VAL . . . -60.52 -36.81 79.29 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.532 178.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.656 ' HG3' ' HB2' ' A' ' 44' ' ' TRP . 57.3 tt0 -57.29 -44.16 83.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.185 -179.246 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 14.4 m -69.36 -41.72 76.2 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.762 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . 0.483 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 38.4 mmt180 -60.03 -43.94 94.98 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.365 -178.119 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.479 HG22 HG11 ' A' ' 79' ' ' VAL . 83.4 t -69.22 -43.4 81.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.95 0.405 . . . . 0.0 111.068 -177.655 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 25.0 t80 -56.8 -46.22 81.73 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.376 179.293 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . 0.483 ' HG3' ' O ' ' A' ' 107' ' ' ARG . 5.3 pp0? -70.11 -36.46 74.86 Favored 'General case' 0 C--O 1.238 0.485 0 N-CA-C 111.677 0.251 . . . . 0.0 111.677 -175.819 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.484 ' HA ' ' HG2' ' A' ' 114' ' ' GLN . 4.5 pp -74.0 -28.05 61.26 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 120.815 -0.354 . . . . 0.0 110.269 179.415 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . 0.513 ' HE1' ' HA ' ' A' ' 41' ' ' ILE . 44.2 ttm -61.89 -39.63 92.61 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.563 175.162 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . 0.455 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 3.2 tm-20 -59.79 -60.88 3.13 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.624 -0.717 . . . . 0.0 110.164 177.56 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . 0.484 ' HG2' ' HA ' ' A' ' 111' ' ' LEU . 13.7 pt20 -64.63 -18.13 64.65 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -173.072 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -110.28 -67.27 1.0 Allowed 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.138 0.494 . . . . 0.0 111.71 -179.542 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 17.4 m -72.5 -31.45 65.37 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.696 -172.589 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . 0.497 ' CE1' HD22 ' A' ' 18' ' ' LEU . 18.3 t80 -81.72 -36.91 28.09 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.175 -0.61 . . . . 0.0 110.924 -177.602 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 22.0 p -60.04 -47.49 85.65 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-O 120.905 0.384 . . . . 0.0 110.45 178.353 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 14.7 ptp180 -61.49 -36.07 79.44 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 176.025 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -65.56 -33.84 76.85 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.557 177.343 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 86.3 mt -65.15 -28.69 69.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.028 0.442 . . . . 0.0 110.196 176.736 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 3.7 tppp? -93.44 -9.86 37.08 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.379 179.157 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 60.7 p -59.85 146.84 40.52 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-O 121.153 0.501 . . . . 0.0 111.578 -176.301 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -59.73 -38.03 80.56 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.173 179.31 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.456 ' O ' ' HG ' ' A' ' 129' ' ' LEU . 0.0 OUTLIER -64.49 -47.04 90.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.66 -176.922 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -66.38 -48.35 70.4 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 120.877 0.37 . . . . 0.0 111.132 -177.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 95.5 mt -63.37 -29.59 70.87 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.871 -179.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -67.79 -39.23 84.04 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.668 177.079 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 125' ' ' ILE . 97.8 mt -61.15 -47.86 84.24 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.988 -179.103 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' MET . . . . . . . . . . . . . 14.8 ptp . . . . . 0 C--N 1.33 -0.24 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.249 -178.846 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 6.8 p . . . . . 0 C--O 1.234 0.243 0 CA-C-O 120.89 0.376 . . . . 0.0 111.56 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 17.3 m -100.17 148.19 34.54 Favored Pre-proline 0 CA--C 1.535 0.383 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.743 175.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo -49.27 -44.22 34.68 Favored 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 123.057 2.505 . . . . 0.0 113.232 -177.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.439 ' HA ' HG22 ' A' ' 9' ' ' VAL . 32.6 mt-10 -70.61 -24.38 62.73 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.222 -177.175 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.404 ' O ' ' HB3' ' A' ' 10' ' ' LYS . 21.2 tp10 -73.21 -34.33 65.88 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 173.187 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.745 ' HB3' ' SD ' ' A' ' 130' ' ' MET . . . -66.68 -42.22 86.85 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.048 179.789 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.439 HG22 ' HA ' ' A' ' 6' ' ' GLU . 27.1 m -68.26 -25.69 32.2 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 CA-C-O 120.971 0.415 . . . . 0.0 110.195 175.594 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.404 ' HB3' ' O ' ' A' ' 7' ' ' GLU . 16.9 tppt? -69.58 -27.86 65.48 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.007 174.074 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 46.8 m0 -72.15 -35.27 69.02 Favored 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 171.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -69.0 -2.64 32.03 Favored Glycine 0 N--CA 1.452 -0.298 0 CA-C-N 115.15 -0.932 . . . . 0.0 113.568 -176.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -115.42 4.44 14.33 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 117.048 0.424 . . . . 0.0 110.507 176.778 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.1 p -161.46 92.95 0.91 Allowed 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 121.039 0.447 . . . . 0.0 111.101 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.413 ' CE1' HD23 ' A' ' 18' ' ' LEU . 13.1 t80 -58.27 -38.6 77.28 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.007 177.851 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -48.88 -42.07 35.47 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.389 173.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -76.12 -27.37 57.05 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.26 -178.473 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.413 HD23 ' CE1' ' A' ' 15' ' ' PHE . 52.8 tp -59.15 -43.27 92.04 Favored 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 110.054 -0.35 . . . . 0.0 110.054 179.008 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -75.31 -32.02 60.84 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.374 176.547 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 43.3 t -61.72 -35.3 77.64 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.476 178.093 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -80.56 115.08 19.89 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 177.195 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.31 -44.3 54.05 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 121.254 0.549 . . . . 0.0 110.583 177.084 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -72.39 -28.23 62.86 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.827 -178.507 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -71.01 -44.83 54.2 Favored Glycine 0 N--CA 1.451 -0.324 0 N-CA-C 111.063 -0.815 . . . . 0.0 111.063 177.084 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.3 tt -62.57 -41.46 98.95 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.923 -0.639 . . . . 0.0 110.481 177.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.498 ' O ' ' HG2' ' A' ' 30' ' ' ARG . 43.6 tt0 -58.84 -47.84 83.43 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.876 0.37 . . . . 0.0 110.211 177.473 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -63.61 -40.86 98.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.963 0.411 . . . . 0.0 110.78 179.241 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 73.2 t80 -64.53 -45.4 87.36 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.071 -177.202 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.531 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 9.7 t -66.54 -41.67 88.35 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 120.91 -0.316 . . . . 0.0 110.558 -179.451 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.498 ' HG2' ' O ' ' A' ' 26' ' ' GLU . 12.1 mmt180 -54.1 -36.01 62.76 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 120.994 0.426 . . . . 0.0 110.395 178.651 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.454 ' O ' HG22 ' A' ' 34' ' ' THR . 63.4 t80 -70.62 -53.73 14.76 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.543 175.579 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 28.2 tp -64.07 -24.1 67.58 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.91 -173.181 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.531 ' HG3' ' O ' ' A' ' 29' ' ' THR . 68.5 mttm -65.02 -14.05 59.43 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 116.749 -0.205 . . . . 0.0 111.336 179.58 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.454 HG22 ' O ' ' A' ' 31' ' ' PHE . 14.3 t -62.82 -34.51 77.46 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 120.851 0.358 . . . . 0.0 110.7 179.275 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -115.76 7.94 14.75 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.13 -175.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 92.5 m-85 59.54 17.09 5.79 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 115.942 -0.572 . . . . 0.0 112.542 173.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 8.4 t -86.86 27.57 0.99 Allowed 'General case' 0 C--O 1.235 0.3 0 CA-C-O 121.63 0.729 . . . . 0.0 109.638 -179.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 64.6 tt0 -71.83 -13.62 61.73 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.956 -177.177 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.469 ' HB3' ' HB3' ' A' ' 77' ' ' LYS . 0.8 OUTLIER -55.74 -26.61 46.39 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 111.704 0.261 . . . . 0.0 111.704 -178.354 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.411 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 57.3 m-80 -61.65 -50.15 73.68 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-O 121.625 0.726 . . . . 0.0 109.944 173.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 61.7 mt -63.5 -49.72 81.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.935 178.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -57.96 -30.87 66.35 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.805 177.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.411 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 79.1 t80 -58.69 -63.23 1.36 Allowed 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.502 179.733 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.581 ' HA ' ' SG ' ' A' ' 47' ' ' CYS . 6.2 p-90 -79.05 -5.99 55.34 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 119.545 -0.862 . . . . 0.0 112.148 -178.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 8.8 mt -69.37 -45.88 77.91 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 166.335 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.45 -32.04 73.49 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.326 177.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.581 ' SG ' ' HA ' ' A' ' 44' ' ' TRP . 73.6 m -64.35 -30.72 71.76 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.801 177.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.463 ' HG3' ' HE3' ' A' ' 51' ' ' LYS . 39.8 tt0 -77.0 -40.86 45.14 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 178.011 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -61.44 -31.64 71.59 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 121.525 0.679 . . . . 0.0 109.671 173.531 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.462 ' CZ ' HG23 ' A' ' 59' ' ' ILE . 56.4 t80 -65.36 -52.67 52.12 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 114.911 -1.04 . . . . 0.0 111.162 178.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.463 ' HE3' ' HG3' ' A' ' 48' ' ' GLU . 0.0 OUTLIER -68.87 -21.49 64.26 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 121.347 0.594 . . . . 0.0 110.028 179.749 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 8.8 tttm -69.68 -19.71 63.58 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.271 173.363 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 15.5 m -84.29 43.66 0.97 Allowed 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.517 179.041 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.19 98.47 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.678 0.752 . . . . 0.0 112.407 -177.477 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . 0.515 ' O ' HG12 ' A' ' 59' ' ' ILE . . . -179.91 129.15 1.3 Allowed Glycine 0 C--O 1.226 -0.392 0 N-CA-C 110.624 -0.99 . . . . 0.0 110.624 176.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_endo -46.29 -58.23 1.79 Allowed 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.951 2.434 . . . . 0.0 112.997 -172.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -71.16 -38.15 72.19 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 120.978 0.418 . . . . 0.0 110.543 -178.566 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.585 ' OE1' HD11 ' A' ' 61' ' ' LEU . 5.4 tp-100 -57.46 -42.31 82.32 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.489 -178.357 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.515 HG12 ' O ' ' A' ' 55' ' ' GLY . 36.9 mm -58.46 -47.12 89.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.312 -178.69 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 16.6 m-70 -64.76 -46.04 83.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.277 -174.499 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.585 HD11 ' OE1' ' A' ' 58' ' ' GLN . 4.5 pp -71.59 -33.23 68.86 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.127 -176.928 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.476 ' N ' HD12 ' A' ' 61' ' ' LEU . 12.3 mmmm -68.55 -42.67 78.05 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 110.095 -0.335 . . . . 0.0 110.095 176.061 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.22 -39.48 90.41 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.372 177.305 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.478 ' O ' ' HB3' ' A' ' 67' ' ' TYR . 4.0 tmtp? -65.3 -38.22 89.53 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.898 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -65.36 -49.85 67.78 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.137 0.494 . . . . 0.0 110.303 177.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 70.8 mt -61.66 -30.65 48.74 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.069 177.128 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.542 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 78.2 t80 -58.85 -58.32 9.14 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.494 178.334 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -70.09 -26.65 64.08 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.88 -0.6 . . . . 0.0 112.095 -172.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 35.2 ttpt -99.87 -28.31 13.18 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 -174.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -120.27 -45.27 2.45 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -176.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.542 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 44.2 mm -76.64 -22.6 15.12 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 CA-C-O 120.573 0.225 . . . . 0.0 110.984 -173.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.502 ' HG3' ' H ' ' A' ' 74' ' ' ASP . 6.3 tp60 -50.54 148.18 4.02 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.735 176.601 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 26.1 m -57.48 -42.85 83.47 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.267 -179.629 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . 0.502 ' H ' ' HG3' ' A' ' 72' ' ' GLN . 6.7 m-20 -82.88 -72.4 0.45 Allowed 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.281 -179.44 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . 69.24 134.71 0.04 OUTLIER Pre-proline 0 CA--C 1.535 0.403 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.761 -177.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -59.33 -35.76 96.05 Favored 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 122.587 2.191 . . . . 0.0 112.044 -178.39 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.469 ' HB3' ' HB3' ' A' ' 39' ' ' GLU . 14.1 mmmm -87.88 -15.61 36.24 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.575 178.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 58.73 83.14 0.13 Allowed 'General case' 0 C--O 1.236 0.387 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.018 -177.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.447 HG12 ' H ' ' A' ' 81' ' ' LEU . 35.9 t -80.93 140.74 16.18 Favored 'Isoleucine or valine' 0 C--O 1.234 0.275 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.48 -176.679 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 23.9 m-80 -88.54 11.26 17.7 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.118 -0.492 . . . . 0.0 112.025 -172.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.49 HD11 HG21 ' A' ' 85' ' ' THR . 25.7 tp -59.15 145.0 44.09 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -175.336 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.455 ' O ' ' HG3' ' A' ' 86' ' ' LYS . 10.9 t70 -55.64 145.33 23.92 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 115.044 -0.98 . . . . 0.0 112.543 -177.76 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 45.7 p90 -67.3 -42.46 83.69 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.812 -175.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . 0.492 ' O ' ' HB3' ' A' ' 87' ' ' GLU . 69.4 t60 -69.15 -29.51 67.56 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.898 0.38 . . . . 0.0 110.341 -177.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.536 ' OG1' ' HG3' ' A' ' 107' ' ' ARG . 22.1 m -67.15 -45.97 75.48 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 176.589 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.455 ' HG3' ' O ' ' A' ' 82' ' ' ASP . 26.3 mtpp -56.65 -39.08 73.08 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 109.26 -0.645 . . . . 0.0 109.26 175.24 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.492 ' HB3' ' O ' ' A' ' 84' ' ' HIS . 56.1 tt0 -58.18 -53.83 53.89 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.601 177.639 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 84' ' ' HIS . 96.9 t -55.14 -43.2 69.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.071 0.462 . . . . 0.0 110.312 179.446 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.405 HG13 ' O ' ' A' ' 85' ' ' THR . 73.9 mt -65.25 -42.43 93.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.091 -179.394 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 41.1 p -64.38 -18.39 64.63 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 120.93 0.395 . . . . 0.0 111.031 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 47.6 m-80 -88.85 -41.56 12.4 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.564 174.472 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 22.8 t -87.83 0.54 55.66 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.572 -174.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 8.9 tp -57.12 -29.1 31.04 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.383 0 CA-C-O 120.945 0.402 . . . . 0.0 111.143 -179.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 9.0 t -68.27 -33.88 75.17 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.826 179.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 75.5 mm-40 -139.25 80.32 23.49 Favored Pre-proline 0 C--O 1.234 0.276 0 CA-C-O 120.988 0.423 . . . . 0.0 110.955 -178.067 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . 0.498 ' HG2' HG22 ' A' ' 59' ' ' ILE . 89.5 Cg_endo -85.72 133.63 4.42 Favored 'Trans proline' 0 N--CA 1.46 -0.461 0 C-N-CA 122.685 2.257 . . . . 0.0 111.774 174.36 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.435 ' N ' ' HB2' ' A' ' 100' ' ' SER . 9.5 p -83.22 176.2 9.35 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.71 176.676 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.439 ' H ' HD22 ' A' ' 98' ' ' LEU . 3.4 mm? -52.14 -45.98 65.2 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.042 0.448 . . . . 0.0 111.229 -175.108 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 7.7 t-80 -116.78 31.85 6.5 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.754 -176.58 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . 0.435 ' HB2' ' N ' ' A' ' 97' ' ' THR . 20.8 t -45.87 -40.09 9.51 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.633 -0.712 . . . . 0.0 112.683 -172.797 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 -76.04 16.5 0.42 Allowed 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 112.001 0.371 . . . . 0.0 112.001 -177.131 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -58.47 -46.99 85.48 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 121.08 0.466 . . . . 0.0 110.786 178.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.409 ' O ' ' HG2' ' A' ' 107' ' ' ARG . . . -58.78 -42.89 90.06 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.403 178.568 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.0 -36.71 85.28 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.649 179.54 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -57.56 -51.44 69.48 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.419 177.327 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . 0.659 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 31.4 t -57.3 -48.55 78.64 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.211 179.655 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . 0.536 ' HG3' ' OG1' ' A' ' 85' ' ' THR . 24.9 mmt180 -53.42 -54.85 30.93 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.317 -179.337 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.527 ' HA ' HD12 ' A' ' 111' ' ' LEU . 98.7 t -60.16 -40.21 82.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.563 -179.604 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . 0.599 ' HA ' ' SD ' ' A' ' 112' ' ' MET . 28.5 t80 -57.25 -41.21 79.18 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.147 178.718 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . 0.659 ' HG3' ' O ' ' A' ' 106' ' ' SER . 48.9 mt-30 -63.46 -39.94 95.81 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 121.55 0.69 . . . . 0.0 109.816 178.659 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.535 ' HG ' ' O ' ' A' ' 107' ' ' ARG . 93.9 mt -59.33 -49.11 79.09 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 114.581 -1.191 . . . . 0.0 111.934 -173.16 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . 0.599 ' SD ' ' HA ' ' A' ' 109' ' ' TYR . 0.0 OUTLIER -91.07 -5.62 54.95 Favored 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 120.364 -0.534 . . . . 0.0 110.956 -179.188 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . 0.632 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 42.3 tt0 -69.97 -66.43 0.59 Allowed 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 174.496 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 28.3 pt20 -51.85 -31.73 29.06 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.579 -177.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -98.65 -72.15 0.66 Allowed 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.653 -177.003 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 14.4 m -71.27 -31.46 67.52 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -168.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . 0.632 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 15.7 t80 -64.48 -57.34 9.5 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 117.829 0.286 . . . . 0.0 110.633 -178.55 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 39.5 p -60.09 -46.65 88.88 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 121.372 0.606 . . . . 0.0 110.327 179.1 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 20.5 ttp85 -61.0 -31.3 70.91 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.831 178.633 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 86.0 t80 -70.87 -39.73 72.71 Favored 'General case' 0 C--O 1.225 -0.218 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 177.09 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 87.9 mt -62.34 -22.53 66.15 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.932 0.396 . . . . 0.0 110.403 178.023 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -101.44 -11.98 18.93 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.998 177.299 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 82.7 p -65.44 144.59 56.96 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 120.662 0.268 . . . . 0.0 111.013 -175.322 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -57.62 -31.14 65.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.214 177.076 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 2.3 mp -52.71 -53.18 21.99 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 CA-C-O 121.298 0.57 . . . . 0.0 110.254 175.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -61.91 -48.3 81.09 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.597 -178.114 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.477 ' HA ' ' HB2' ' A' ' 130' ' ' MET . 3.9 mm? -68.05 -20.35 64.97 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.106 -179.507 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -76.92 -26.27 53.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.065 0.46 . . . . 0.0 110.192 177.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 70.8 mt -82.49 -34.86 27.85 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 107.268 -1.382 . . . . 0.0 107.268 175.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' MET . . . . . 0.745 ' SD ' ' HB3' ' A' ' 8' ' ' ALA . 83.2 mmm . . . . . 0 N--CA 1.442 -0.855 0 CA-C-N 113.272 -1.785 . . . . 0.0 110.656 178.66 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.474 HG23 ' HB3' ' A' ' 7' ' ' GLU . 1.5 p . . . . . 0 CA--C 1.532 0.257 0 CA-C-O 121.122 0.487 . . . . 0.0 111.349 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 45.1 t -80.73 154.46 73.39 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.536 175.538 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_endo -48.12 -36.64 29.0 Favored 'Trans proline' 0 C--N 1.353 0.773 0 C-N-CA 122.701 2.268 . . . . 0.0 112.108 176.188 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.501 ' O ' ' HG2' ' A' ' 10' ' ' LYS . 33.5 mt-10 -70.28 -32.36 70.13 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 121.282 0.563 . . . . 0.0 110.543 178.421 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.474 ' HB3' HG23 ' A' ' 3' ' ' VAL . 18.9 tp10 -71.99 -32.63 67.4 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 176.583 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.94 -46.53 84.3 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.855 178.553 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.458 HG22 ' O ' ' A' ' 6' ' ' GLU . 19.8 m -66.45 -26.65 38.17 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.23 0 C-N-CA 121.054 -0.258 . . . . 0.0 110.491 179.026 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.501 ' HG2' ' O ' ' A' ' 6' ' ' GLU . 74.2 mmtt -62.81 -44.32 96.46 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.952 0.406 . . . . 0.0 110.016 172.334 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 39.0 m0 -64.49 -27.61 69.1 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.27 0.557 . . . . 0.0 109.863 176.615 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -76.99 -14.51 82.56 Favored Glycine 0 N--CA 1.449 -0.499 0 CA-C-N 115.326 -0.852 . . . . 0.0 112.647 178.47 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -69.84 -50.83 38.88 Favored 'General case' 0 CA--C 1.521 -0.173 0 CA-C-O 121.203 0.525 . . . . 0.0 110.279 178.129 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 28.6 m -152.45 134.07 14.61 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.602 -175.073 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.43 ' CE1' HD23 ' A' ' 18' ' ' LEU . 1.7 t80 -60.29 -35.06 74.71 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.478 -178.205 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -65.03 -32.98 74.97 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.459 179.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 4.3 ttmp? -65.95 -38.46 88.64 Favored 'General case' 0 N--CA 1.464 0.253 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 177.146 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.43 HD23 ' CE1' ' A' ' 15' ' ' PHE . 56.5 tp -58.22 -46.81 85.2 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.947 174.677 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.418 ' HG ' ' HH2' ' A' ' 44' ' ' TRP . 6.7 mp -62.77 -37.56 87.14 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.191 177.631 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 52.4 m -73.06 -11.7 60.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.341 -177.531 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -98.26 114.18 26.37 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 179.549 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 10.7 mmt85 -50.27 -48.53 54.78 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.091 0.472 . . . . 0.0 111.129 177.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -69.25 -19.25 63.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.511 -179.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -80.47 -44.67 8.47 Favored Glycine 0 C--N 1.334 0.436 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.594 178.536 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.41 HD11 HD12 ' A' ' 45' ' ' ILE . 7.1 tp -50.51 -51.66 45.49 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.542 0.686 . . . . 0.0 109.913 173.2 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.431 ' O ' ' HG3' ' A' ' 30' ' ' ARG . 9.0 tp10 -58.93 -52.99 63.36 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.603 -1.18 . . . . 0.0 110.703 -178.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -58.38 -39.54 79.9 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.993 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -67.11 -49.26 65.55 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.801 -178.487 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.501 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 14.6 t -66.2 -36.68 83.7 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 110.363 -0.236 . . . . 0.0 110.363 -177.254 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.431 ' HG3' ' O ' ' A' ' 26' ' ' GLU . 62.9 mtp180 -57.52 -41.9 81.75 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 120.888 0.375 . . . . 0.0 110.513 176.889 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.568 ' O ' HG22 ' A' ' 34' ' ' THR . 51.3 t80 -72.64 -43.79 62.74 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.453 176.621 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.489 HD21 ' OD1' ' A' ' 40' ' ' ASN . 19.4 tp -62.08 -28.56 69.7 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.184 -174.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.573 ' HG2' ' HB3' ' A' ' 38' ' ' GLU . 99.2 mttt -79.78 -4.87 53.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.534 -179.583 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.568 HG22 ' O ' ' A' ' 31' ' ' PHE . 1.0 OUTLIER -84.62 -17.74 37.7 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 176.039 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -113.44 0.73 14.83 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.747 177.566 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 48.0 t80 68.28 16.79 9.33 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.804 174.708 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 31.7 m -85.28 9.17 16.03 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 121.099 0.476 . . . . 0.0 110.327 177.099 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.573 ' HB3' ' HG2' ' A' ' 33' ' ' LYS . 10.0 pt-20 -56.31 -19.31 13.76 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.429 -0.805 . . . . 0.0 112.454 -177.515 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -50.04 -37.92 35.46 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.341 -179.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.536 ' ND2' ' HB3' ' A' ' 112' ' ' MET . 28.6 p30 -81.23 -39.04 25.98 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-N 115.934 -0.576 . . . . 0.0 112.224 -172.272 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.454 HG22 ' O ' ' A' ' 38' ' ' GLU . 9.8 tp -65.8 -43.64 93.26 Favored 'Isoleucine or valine' 0 C--O 1.234 0.254 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 -179.419 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.41 ' HA ' HG22 ' A' ' 45' ' ' ILE . 0.6 OUTLIER -66.32 -31.8 72.81 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.735 176.359 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.424 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 81.7 t80 -55.11 -70.19 0.11 Allowed 'General case' 0 C--O 1.238 0.491 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.558 179.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.418 ' HH2' ' HG ' ' A' ' 19' ' ' LEU . 28.4 p-90 -81.72 -15.82 53.15 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 119.854 -0.738 . . . . 0.0 112.67 -171.418 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.41 HG22 ' HA ' ' A' ' 42' ' ' GLU . 10.8 tt -67.13 -35.76 75.15 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 173.451 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.49 -36.64 83.24 Favored 'General case' 0 N--CA 1.456 -0.128 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.574 173.546 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 72.8 m -66.32 -24.62 66.56 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.075 176.678 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.528 ' HA ' ' HB2' ' A' ' 51' ' ' LYS . 12.6 mm-40 -83.37 -22.87 32.67 Favored 'General case' 0 C--O 1.233 0.218 0 O-C-N 122.272 -0.268 . . . . 0.0 110.556 175.644 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.426 ' HA ' ' HG2' ' A' ' 52' ' ' LYS . 24.5 t70 -68.06 -42.56 80.28 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 168.327 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.423 ' CE1' HG23 ' A' ' 59' ' ' ILE . 6.3 t80 -57.02 -32.87 66.61 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.711 -1.132 . . . . 0.0 110.197 170.282 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.528 ' HB2' ' HA ' ' A' ' 48' ' ' GLU . 0.0 OUTLIER -73.45 -40.42 64.19 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.297 -176.905 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.426 ' HG2' ' HA ' ' A' ' 49' ' ' ASP . 7.0 ptmm? -74.78 -26.63 59.88 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 120.579 0.228 . . . . 0.0 111.154 179.667 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 28.8 p -77.84 67.34 3.69 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-O 121.174 0.512 . . . . 0.0 109.691 175.412 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.491 ' HB2' ' NZ ' ' A' ' 54' ' ' LYS . 0.0 OUTLIER -77.08 16.96 0.49 Allowed 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.387 -0.824 . . . . 0.0 113.162 -170.937 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -68.94 133.78 27.06 Favored Glycine 0 CA--C 1.52 0.398 0 C-N-CA 120.451 -0.881 . . . . 0.0 110.937 176.052 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -54.21 -42.1 70.25 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.729 2.286 . . . . 0.0 112.642 -174.177 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -89.07 -29.1 19.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.17 0.51 . . . . 0.0 109.908 179.005 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.489 ' OE1' HD11 ' A' ' 61' ' ' LEU . 4.7 tp-100 -56.23 -42.25 76.99 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.714 178.296 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.423 HG23 ' CE1' ' A' ' 50' ' ' PHE . 29.9 mm -54.58 -39.6 46.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.308 178.295 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 19.9 m-70 -66.02 -52.06 52.67 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.185 -175.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.489 HD11 ' OE1' ' A' ' 58' ' ' GLN . 4.6 pp -69.74 -32.21 70.62 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.964 -177.459 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.489 ' N ' HD12 ' A' ' 61' ' ' LEU . 66.6 mmtt -66.69 -43.65 83.83 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 121.174 0.512 . . . . 0.0 109.997 174.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.22 -47.54 85.55 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.952 -179.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 3.5 tppp? -63.66 -35.37 80.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.502 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.83 -53.27 59.9 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.048 0.451 . . . . 0.0 110.401 177.661 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 65.5 mt -62.9 -37.62 79.71 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.392 178.154 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.549 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 71.9 t80 -57.21 -56.87 16.22 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.735 -179.487 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.458 ' HA ' ' HG2' ' A' ' 72' ' ' GLN . 42.8 mt-10 -70.69 -30.09 66.57 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.529 -175.203 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 58.2 tttm -90.9 -19.04 23.78 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.723 -173.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 99.4 m-85 -136.35 -53.2 0.73 Allowed 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -176.052 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.549 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 45.7 mm -73.1 -24.09 20.58 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -167.433 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.458 ' HG2' ' HA ' ' A' ' 68' ' ' GLU . 13.5 mm-40 -53.67 139.88 30.91 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 120.851 0.358 . . . . 0.0 111.244 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 65.2 m -71.97 69.68 0.73 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.609 0.719 . . . . 0.0 110.089 176.25 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 21.2 t70 170.59 -76.69 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 107.406 -1.331 . . . . 0.0 107.406 -178.274 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.406 ' HA ' ' HD3' ' A' ' 76' ' ' PRO . . . 59.95 149.07 0.08 OUTLIER Pre-proline 0 CA--C 1.538 0.493 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 169.622 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 75' ' ' ALA . 21.3 Cg_exo -67.43 -20.07 48.5 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 122.508 2.139 . . . . 0.0 111.625 173.815 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.757 ' HE2' ' HA ' ' A' ' 77' ' ' LYS . 11.2 mmpt? -105.25 -19.7 13.73 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.149 -179.379 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 52.19 77.98 0.14 Allowed 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 121.317 0.58 . . . . 0.0 110.082 -175.704 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 59.0 t -84.94 117.52 30.35 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.95 -175.605 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -80.23 77.39 6.97 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.35 0.595 . . . . 0.0 110.35 179.261 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 20.5 tp -110.75 148.06 33.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.891 176.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -49.57 128.61 17.92 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.285 -178.271 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.412 ' O ' ' HG2' ' A' ' 86' ' ' LYS . 38.2 p90 -52.19 -42.78 63.79 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.412 -179.78 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . 0.442 ' O ' HG23 ' A' ' 88' ' ' VAL . 68.7 t60 -68.07 -39.7 82.91 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.674 -0.239 . . . . 0.0 110.88 -178.385 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 40.6 m -63.71 -46.49 85.24 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.917 0.389 . . . . 0.0 110.547 -179.26 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.412 ' HG2' ' O ' ' A' ' 83' ' ' PHE . 12.0 ptmm? -72.12 -21.95 61.4 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.153 179.688 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -69.92 -46.54 65.14 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.227 174.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 84' ' ' HIS . 87.6 t -54.84 -36.98 39.3 Favored 'Isoleucine or valine' 0 C--O 1.235 0.32 0 CA-C-O 121.287 0.565 . . . . 0.0 109.61 175.242 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.409 HD12 ' HA ' ' A' ' 86' ' ' LYS . 74.4 mt -63.15 -46.48 95.84 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.71 176.304 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 72.1 p -63.94 -22.57 66.98 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.067 0.46 . . . . 0.0 111.094 -179.215 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 79.6 m-20 -85.6 -31.1 22.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.542 178.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 20.7 m -98.2 -1.84 41.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.469 -176.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 11.0 tp -66.33 -15.01 18.47 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 CA-C-O 121.106 0.479 . . . . 0.0 111.238 -176.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 8.0 t -89.3 -6.95 56.31 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.909 178.487 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.489 ' N ' ' HD3' ' A' ' 96' ' ' PRO . 25.5 pt20 -160.79 56.92 0.81 Allowed Pre-proline 0 CA--C 1.536 0.43 0 CA-C-O 120.973 0.416 . . . . 0.0 110.495 -179.132 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . 0.489 ' HD3' ' N ' ' A' ' 95' ' ' GLN . 23.9 Cg_exo -63.06 134.19 44.82 Favored 'Trans proline' 0 C--N 1.351 0.698 0 C-N-CA 122.798 2.332 . . . . 0.0 112.501 -174.4 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.449 ' H ' ' HB2' ' A' ' 100' ' ' SER . 52.7 p -90.87 168.84 11.41 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.434 176.454 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 34.9 tp -55.54 -47.1 76.85 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 120.972 0.415 . . . . 0.0 111.151 -177.538 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' HIS . . . . . 0.445 ' HB3' ' HB2' ' A' ' 102' ' ' ASP . 45.9 m-70 -108.67 36.98 2.65 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.818 0.342 . . . . 0.0 110.492 178.558 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . 0.449 ' HB2' ' H ' ' A' ' 97' ' ' THR . 15.6 t -59.22 -48.98 79.61 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.064 0.459 . . . . 0.0 110.511 178.341 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.476 ' O ' ' HG3' ' A' ' 105' ' ' GLN . 84.3 m-85 -80.21 -1.52 40.91 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.591 -177.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . 0.445 ' HB2' ' HB3' ' A' ' 99' ' ' HIS . 16.1 t70 -52.88 -42.71 65.54 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 120.993 0.425 . . . . 0.0 110.608 -176.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.58 ' O ' ' HG2' ' A' ' 107' ' ' ARG . . . -57.22 -51.31 69.85 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.464 176.699 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.69 -40.18 87.02 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.979 -179.314 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.476 ' HG3' ' O ' ' A' ' 101' ' ' PHE . 25.9 mt-30 -60.63 -43.86 97.04 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.921 178.645 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 25.8 t -62.23 -37.43 85.38 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.605 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . 0.58 ' HG2' ' O ' ' A' ' 103' ' ' ALA . 16.3 mmm180 -65.42 -60.53 2.86 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.051 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 53.7 t -53.46 -40.66 41.82 Favored 'Isoleucine or valine' 0 C--O 1.239 0.54 0 CA-C-O 121.39 0.614 . . . . 0.0 110.865 178.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . 0.544 ' HA ' ' HE3' ' A' ' 112' ' ' MET . 30.4 t80 -60.68 -51.89 67.44 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.312 -179.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . 0.585 ' NE2' HD12 ' A' ' 111' ' ' LEU . 0.0 OUTLIER -61.81 -28.83 69.75 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 120.485 0.183 . . . . 0.0 110.509 -175.189 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.585 HD12 ' NE2' ' A' ' 110' ' ' GLN . 10.1 mp -60.56 -68.1 0.33 Allowed 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.316 175.179 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . 0.544 ' HE3' ' HA ' ' A' ' 109' ' ' TYR . 0.0 OUTLIER -68.97 -12.46 61.69 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.475 -175.171 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . 0.558 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 44.5 tt0 -64.43 -63.8 1.04 Allowed 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 172.637 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 29.8 pt20 -68.62 -20.69 64.5 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.463 -175.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -95.3 -63.09 1.2 Allowed 'General case' 0 C--O 1.233 0.214 0 CA-C-O 120.748 0.308 . . . . 0.0 111.588 -179.289 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 23.8 m -86.22 -37.23 18.87 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 112.709 0.633 . . . . 0.0 112.709 -170.642 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . 0.558 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 31.3 t80 -64.25 -37.44 87.5 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 120.866 -0.333 . . . . 0.0 110.751 -176.036 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 24.5 p -59.45 -46.38 88.92 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 121.533 0.682 . . . . 0.0 109.74 175.15 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 22.4 mmt180 -60.81 -38.49 85.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.48 176.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -61.04 -41.12 95.98 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.444 178.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 87.6 mt -69.36 -22.63 63.72 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.309 -178.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . 0.72 ' HA ' ' HE3' ' A' ' 122' ' ' LYS . 0.0 OUTLIER -115.38 15.02 16.86 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.598 0.237 . . . . 0.0 111.602 178.61 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 96.2 p -74.7 145.86 42.76 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 120.939 0.4 . . . . 0.0 111.117 -179.217 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -56.08 -36.59 68.27 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.802 176.735 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.527 ' O ' ' HG ' ' A' ' 129' ' ' LEU . 8.2 tp -66.87 -40.68 86.33 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.553 -179.561 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 84.6 t80 -63.41 -42.88 98.77 Favored 'General case' 0 C--O 1.232 0.175 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 176.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 93.3 mt -64.32 -29.4 70.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.222 176.601 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -71.14 -29.67 65.52 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.934 177.159 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.527 ' HG ' ' O ' ' A' ' 125' ' ' ILE . 69.6 mt -75.19 -25.41 58.22 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.136 176.197 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.533 0.298 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.417 -179.08 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.454 ' CG2' ' HB3' ' A' ' 7' ' ' GLU . 9.1 p . . . . . 0 C--O 1.233 0.193 0 CA-C-O 120.782 0.325 . . . . 0.0 111.326 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 35.4 t -88.15 148.13 42.15 Favored Pre-proline 0 CA--C 1.534 0.344 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.809 177.359 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_exo -45.41 -33.76 9.57 Favored 'Trans proline' 0 C--N 1.357 0.984 0 C-N-CA 123.003 2.468 . . . . 0.0 112.772 178.499 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.441 ' O ' HG22 ' A' ' 9' ' ' VAL . 12.6 mm-40 -53.91 -65.01 0.64 Allowed 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.193 0.52 . . . . 0.0 110.734 177.058 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.454 ' HB3' ' CG2' ' A' ' 3' ' ' VAL . 8.1 tp10 -64.57 -33.21 75.39 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.095 -178.372 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.23 -48.24 82.34 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.496 -179.025 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.553 HG23 ' HD2' ' A' ' 10' ' ' LYS . 31.8 m -69.25 -28.52 39.03 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 C-N-CA 120.914 -0.314 . . . . 0.0 110.571 179.781 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.553 ' HD2' HG23 ' A' ' 9' ' ' VAL . 3.1 mptp? -68.59 -29.57 68.13 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.644 0.259 . . . . 0.0 110.689 175.649 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 50.7 m0 -63.89 -32.41 73.92 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 170.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -79.92 0.95 81.29 Favored Glycine 0 C--N 1.331 0.304 0 CA-C-N 115.362 -0.836 . . . . 0.0 113.099 -177.602 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.547 ' HG2' ' HA ' ' A' ' 10' ' ' LYS . 11.2 pt-20 -130.65 0.86 4.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.857 0.36 . . . . 0.0 110.418 177.236 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.1 m -152.46 99.02 2.44 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.494 -179.004 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.405 ' HE2' ' HB2' ' A' ' 117' ' ' TYR . 36.8 t80 -59.48 -36.01 75.2 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.141 0.496 . . . . 0.0 109.765 178.034 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -57.21 -38.31 73.52 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.277 176.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.638 ' HB2' ' NZ ' ' A' ' 17' ' ' LYS . 1.0 OUTLIER -75.69 -30.09 59.22 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.245 -0.888 . . . . 0.0 110.184 -173.37 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 65.8 tp -59.85 -47.2 86.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.68 173.334 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 7.5 mp -77.14 -25.37 51.95 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.987 178.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 42.8 t -62.45 -29.63 70.66 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.388 178.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -95.13 129.8 42.1 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.106 176.142 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.641 HH11 ' HB2' ' A' ' 26' ' ' GLU . 2.1 tmt_? -58.27 -33.46 69.44 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 176.557 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -61.85 -52.71 63.03 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.986 177.225 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -63.36 -37.8 95.41 Favored Glycine 0 C--N 1.334 0.419 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.89 -179.298 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 16.1 tp -54.16 -58.09 8.67 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.096 0.474 . . . . 0.0 110.481 175.626 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.641 ' HB2' HH11 ' A' ' 22' ' ' ARG . 15.6 tp10 -65.65 -40.8 92.86 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.534 -176.272 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.43 ' O ' ' HG3' ' A' ' 30' ' ' ARG . . . -61.14 -45.77 93.28 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-O 121.008 0.433 . . . . 0.0 110.71 179.072 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -70.92 -41.11 71.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.899 -177.49 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.531 HG22 ' HA ' ' A' ' 26' ' ' GLU . 14.9 t -69.93 -42.74 72.87 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 120.816 -0.354 . . . . 0.0 110.701 -177.917 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.472 ' NH1' HD11 ' A' ' 125' ' ' ILE . 0.0 OUTLIER -63.58 -27.32 69.17 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.037 0.446 . . . . 0.0 109.811 179.245 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.591 ' O ' HG22 ' A' ' 34' ' ' THR . 93.8 t80 -77.12 -44.3 30.92 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.701 -0.682 . . . . 0.0 109.802 174.068 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.417 HD23 ' HA ' ' A' ' 38' ' ' GLU . 22.9 tp -69.82 -16.63 63.31 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.789 -176.426 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.563 ' HG2' ' HG2' ' A' ' 38' ' ' GLU . 98.2 mttt -81.94 -18.21 44.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.492 179.294 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.591 HG22 ' O ' ' A' ' 31' ' ' PHE . 2.5 t -72.03 -28.48 63.39 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 121.286 0.565 . . . . 0.0 109.613 178.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -102.15 -1.64 31.01 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.283 176.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 94.5 m-85 52.63 67.66 0.95 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.373 -179.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 29.5 t -132.42 12.17 4.54 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.926 177.641 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.563 ' HG2' ' HG2' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -63.78 -18.0 63.64 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.969 179.364 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.424 ' HG3' ' N ' ' A' ' 40' ' ' ASN . 7.5 pt-20 -43.56 -42.5 5.08 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.027 171.775 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.485 ' HB3' HG13 ' A' ' 108' ' ' VAL . 57.1 m-80 -64.02 -46.45 84.42 Favored 'General case' 0 C--O 1.243 0.713 0 CA-C-N 115.329 -0.851 . . . . 0.0 111.404 -175.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.449 ' O ' HG13 ' A' ' 45' ' ' ILE . 32.4 mt -60.77 -51.75 69.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.171 179.831 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -64.57 -24.32 67.56 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.293 178.155 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.482 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 84.2 t80 -58.32 -60.98 2.92 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.711 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 6.7 p-90 -75.88 -17.73 59.68 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 119.762 -0.775 . . . . 0.0 111.854 -178.537 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.449 HG13 ' O ' ' A' ' 41' ' ' ILE . 33.6 mt -60.76 -47.04 94.9 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 170.578 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.41 -34.75 79.04 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.634 178.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.772 ' SG ' ' HB2' ' A' ' 101' ' ' PHE . 49.8 t -60.95 -41.68 96.78 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.507 178.831 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -71.53 -31.09 66.66 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 121.131 0.491 . . . . 0.0 109.997 179.136 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.773 ' HA ' ' HE2' ' A' ' 52' ' ' LYS . 77.8 m-20 -66.08 -32.12 73.4 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 121.308 0.575 . . . . 0.0 109.748 174.702 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 43.3 t80 -70.0 -35.53 74.44 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.455 176.212 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 6.1 tmtm? -58.9 -35.66 73.41 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.697 175.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.773 ' HE2' ' HA ' ' A' ' 49' ' ' ASP . 1.9 mppt? -58.25 -47.7 82.73 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.022 175.481 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.401 ' HB2' ' CG ' ' A' ' 58' ' ' GLN . 6.2 p -74.52 79.66 1.95 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.199 0.523 . . . . 0.0 110.627 -178.451 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.63 11.32 9.11 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 115.438 -0.801 . . . . 0.0 112.525 -176.299 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . 0.541 ' O ' HG12 ' A' ' 59' ' ' ILE . . . -69.3 126.61 19.77 Favored Glycine 0 CA--C 1.52 0.383 0 C-N-CA 120.81 -0.709 . . . . 0.0 111.521 177.344 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -52.84 -47.75 25.73 Favored 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 122.734 2.29 . . . . 0.0 113.081 -174.169 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 69.4 mt-30 -75.22 -40.85 58.76 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 178.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.557 ' O ' ' HB2' ' A' ' 62' ' ' LYS . 27.8 tp60 -51.17 -39.19 55.82 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 114.858 -1.065 . . . . 0.0 110.704 178.933 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.541 HG12 ' O ' ' A' ' 55' ' ' GLY . 29.6 mm -50.59 -48.41 26.85 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.596 179.527 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 46.2 m-70 -68.07 -54.23 19.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.994 -173.026 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.498 HD11 HE22 ' A' ' 58' ' ' GLN . 3.7 pp -69.42 -25.81 64.31 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.084 -176.704 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.557 ' HB2' ' O ' ' A' ' 58' ' ' GLN . 2.0 tmtm? -70.21 -45.73 66.0 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 175.473 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.51 -32.66 71.67 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.545 177.11 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . 0.421 ' O ' ' HB3' ' A' ' 67' ' ' TYR . 16.2 tppt? -58.94 -46.93 86.81 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.952 0.406 . . . . 0.0 110.267 174.921 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.23 -43.77 98.34 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.599 179.067 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 64.0 mt -68.76 -29.46 43.71 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.312 178.072 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.589 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 92.0 t80 -61.65 -63.83 1.14 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.325 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -61.22 -37.07 81.7 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.711 -175.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -83.46 -37.91 22.54 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -173.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -120.67 -50.14 2.21 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -171.506 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.589 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 49.2 mm -71.67 -31.08 40.68 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 CA-C-O 120.49 0.185 . . . . 0.0 111.36 -169.176 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 12.2 mm-40 -58.15 145.64 36.27 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.168 0.509 . . . . 0.0 111.233 178.513 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 27.7 m -77.47 -45.95 24.05 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 169.756 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -85.49 60.79 6.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.569 172.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.581 ' HB3' ' HA ' ' A' ' 78' ' ' GLU . . . -97.76 161.18 26.6 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.315 -178.685 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_exo -49.6 -53.25 7.35 Favored 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 122.798 2.332 . . . . 0.0 112.745 179.216 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.524 ' O ' ' HD3' ' A' ' 77' ' ' LYS . 1.4 tmtp? -108.99 -23.25 11.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.01 -179.126 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.581 ' HA ' ' HB3' ' A' ' 75' ' ' ALA . 36.4 mt-10 70.4 156.38 0.15 Allowed 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.435 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.44 HG12 ' H ' ' A' ' 81' ' ' LEU . 50.7 t -130.5 133.09 64.18 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.643 176.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 35.9 m-80 -79.48 20.49 0.55 Allowed 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 122.617 0.367 . . . . 0.0 111.869 -176.326 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.44 ' H ' HG12 ' A' ' 79' ' ' VAL . 14.1 tp -62.93 147.42 50.44 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.899 176.814 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -46.57 126.34 8.17 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.852 178.641 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.547 ' HA ' ' HD3' ' A' ' 86' ' ' LYS . 87.1 t80 -57.02 -39.58 75.04 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.181 -178.368 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 83.2 t60 -66.01 -29.74 70.16 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.714 0.292 . . . . 0.0 110.834 -178.266 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 56.8 m -71.43 -46.66 59.52 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 175.454 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.565 ' O ' HG23 ' A' ' 90' ' ' THR . 26.1 mtpp -55.99 -41.49 74.92 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.584 175.223 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -52.9 -59.72 4.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 114.887 -1.051 . . . . 0.0 111.107 -179.928 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 61.3 t -56.49 -40.71 69.57 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.908 -178.104 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 75.2 mt -66.92 -47.7 81.73 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.19 -178.113 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.565 HG23 ' O ' ' A' ' 86' ' ' LYS . 82.8 p -59.8 -31.27 69.55 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 120.922 0.392 . . . . 0.0 111.117 -176.694 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -85.13 -24.5 27.98 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.99 -179.784 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 32.3 t -97.0 2.14 51.11 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.802 -179.647 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.5 tp -53.3 -29.98 16.79 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.819 -177.156 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 8.8 t -61.85 -38.39 88.06 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.955 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -141.91 81.0 15.0 Favored Pre-proline 0 N--CA 1.464 0.259 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.502 -179.652 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . 0.45 ' HG2' HG22 ' A' ' 59' ' ' ILE . 93.2 Cg_endo -86.62 143.33 7.26 Favored 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 122.662 2.241 . . . . 0.0 111.706 176.566 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.448 ' H ' ' HB3' ' A' ' 100' ' ' SER . 36.7 p -79.39 171.55 15.01 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.135 177.559 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 36.2 tp -57.54 -30.63 65.36 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.61 -174.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' HIS . . . . . 0.435 ' O ' ' HB2' ' A' ' 102' ' ' ASP . 0.1 OUTLIER -132.63 43.55 2.97 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 177.939 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . 0.448 ' HB3' ' H ' ' A' ' 97' ' ' THR . 6.3 p -53.12 -33.47 52.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.428 -0.806 . . . . 0.0 112.076 -178.723 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.772 ' HB2' ' SG ' ' A' ' 47' ' ' CYS . 38.7 m-85 -83.2 9.38 10.74 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.223 -176.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . 0.435 ' HB2' ' O ' ' A' ' 99' ' ' HIS . 19.0 t70 -56.94 -44.75 82.84 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 121.009 0.433 . . . . 0.0 110.966 -176.371 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.01 -31.98 71.58 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.57 178.078 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.425 ' HB3' ' O ' ' A' ' 101' ' ' PHE . . . -66.46 -37.03 84.23 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.498 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.402 ' OE1' ' HA ' ' A' ' 102' ' ' ASP . 1.4 mp0 -54.57 -41.68 70.13 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 120.826 0.346 . . . . 0.0 110.288 176.209 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 49.0 m -62.24 -53.37 56.13 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.592 -179.269 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 39.5 mmt-85 -57.49 -48.97 77.8 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.239 -179.679 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.485 HG13 ' HB3' ' A' ' 40' ' ' ASN . 71.2 t -64.29 -52.52 54.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.863 -176.027 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -56.11 -53.74 53.37 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.462 -176.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.1 -31.02 71.21 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.834 -175.043 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 54.4 tp -65.24 -47.97 74.92 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.506 -179.224 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 62.8 mtm -62.33 -39.35 92.78 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.176 0.512 . . . . 0.0 110.146 178.133 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . 0.612 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 38.4 tt0 -58.93 -62.5 1.83 Allowed 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.302 -175.848 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -54.4 -31.56 55.24 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 -169.338 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -105.28 -63.21 1.26 Allowed 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 112.085 0.402 . . . . 0.0 112.085 -175.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 22.5 t -70.52 -42.3 71.44 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.686 0.279 . . . . 0.0 111.101 -173.52 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . 0.612 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 28.3 t80 -67.48 -35.77 79.82 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.725 -0.216 . . . . 0.0 111.321 -175.495 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 29.8 p -65.45 -49.54 68.77 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-O 120.856 0.36 . . . . 0.0 110.366 178.538 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 38.4 ttt180 -62.54 -34.33 76.71 Favored 'General case' 0 C--O 1.225 -0.201 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 176.127 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 83.5 t80 -61.35 -33.85 74.32 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.198 177.223 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 81.5 mt -68.96 -24.74 64.29 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.767 0.317 . . . . 0.0 110.737 177.117 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 17.7 tptt -113.39 15.08 19.24 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 120.963 -0.295 . . . . 0.0 111.576 177.53 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 92.5 p -73.14 157.92 36.29 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.637 0.256 . . . . 0.0 110.53 -179.506 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -55.17 -28.32 52.02 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.041 0.448 . . . . 0.0 110.067 175.362 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.472 HD11 ' NH1' ' A' ' 30' ' ' ARG . 58.9 mt -62.43 -56.75 15.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.452 177.148 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' TYR . . . . . 0.51 ' OH ' ' HA ' ' A' ' 9' ' ' VAL . 32.0 t80 -70.21 -39.37 75.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.555 -175.004 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 98.5 mt -60.72 -32.28 71.55 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 121.099 0.476 . . . . 0.0 110.062 177.022 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -66.82 -36.84 83.29 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.231 177.053 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 72.4 mt -74.25 -29.26 61.6 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.753 177.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' MET . . . . . . . . . . . . . 21.3 mmt . . . . . 0 N--CA 1.467 0.417 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.425 -177.853 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 2.6 p . . . . . 0 CA--C 1.53 0.187 0 CA-C-O 121.189 0.519 . . . . 0.0 111.151 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.6 m -119.75 162.37 33.2 Favored Pre-proline 0 CA--C 1.534 0.333 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.39 178.335 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo -41.83 -48.53 5.92 Favored 'Trans proline' 0 C--N 1.356 0.921 0 C-N-CA 123.16 2.574 . . . . 0.0 113.339 -179.802 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.639 ' O ' ' HG2' ' A' ' 10' ' ' LYS . 49.9 mt-10 -62.81 -40.81 98.51 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 120.749 0.309 . . . . 0.0 110.978 179.765 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 15.4 tp10 -63.47 -36.41 83.65 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.185 0.517 . . . . 0.0 109.729 177.765 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.08 -41.0 91.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.263 -179.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.578 HG22 ' O ' ' A' ' 6' ' ' GLU . 16.3 m -69.97 -25.11 27.27 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.239 0 C-N-CA 120.797 -0.361 . . . . 0.0 110.42 179.918 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.639 ' HG2' ' O ' ' A' ' 6' ' ' GLU . 74.6 mmtt -64.12 -32.22 73.7 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 121.377 0.608 . . . . 0.0 109.667 175.199 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 31.4 m0 -79.36 -33.49 42.89 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.437 176.594 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -72.38 -0.49 46.71 Favored Glycine 0 C--N 1.334 0.441 0 CA-C-N 115.308 -0.86 . . . . 0.0 112.975 -179.577 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -115.51 -4.66 12.26 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.848 0.324 . . . . 0.0 110.889 176.506 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 43.7 t -165.32 111.05 0.92 Allowed 'General case' 0 C--O 1.234 0.264 0 CA-C-O 120.862 0.363 . . . . 0.0 111.247 -177.707 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 41.4 t80 -63.15 -32.95 74.46 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 174.381 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -58.75 -39.44 80.95 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.034 -0.984 . . . . 0.0 110.588 174.656 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.47 ' HD2' ' O ' ' A' ' 10' ' ' LYS . 38.8 ttmt -76.27 -33.86 59.12 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.402 -179.878 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 53.4 tp -55.76 -46.62 77.84 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 121.203 0.525 . . . . 0.0 110.197 176.16 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.451 HD23 ' CZ2' ' A' ' 44' ' ' TRP . 4.4 mp -76.05 -23.77 55.11 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.851 179.748 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.0 t -70.97 -25.73 62.84 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.927 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -97.8 123.53 41.8 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 69.4 mtp180 -52.66 -39.47 61.87 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 120.738 0.304 . . . . 0.0 110.859 -179.147 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -54.84 -47.25 74.38 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.683 -0.69 . . . . 0.0 109.996 177.613 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -71.21 -40.23 61.49 Favored Glycine 0 N--CA 1.45 -0.367 0 CA-C-N 115.385 -0.825 . . . . 0.0 112.0 -179.119 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.425 ' O ' HG22 ' A' ' 29' ' ' THR . 10.0 tt -58.66 -47.99 82.58 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 178.635 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -57.42 -57.14 13.95 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.333 178.331 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -58.38 -40.81 83.34 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.361 -177.346 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 93.2 t80 -74.31 -40.99 61.87 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.722 -175.572 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.626 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 11.7 t -72.54 -41.12 66.15 Favored 'General case' 0 CA--C 1.515 -0.39 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 -175.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 11.0 ttm180 -56.18 -42.16 76.64 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.167 173.433 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.509 ' O ' HG22 ' A' ' 34' ' ' THR . 89.1 t80 -67.46 -28.98 68.32 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.993 179.063 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 32.4 tp -86.58 -27.61 23.8 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 121.062 0.458 . . . . 0.0 110.869 -178.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.626 ' HG3' ' O ' ' A' ' 29' ' ' THR . 68.3 mttm -72.57 -17.93 61.66 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.874 179.807 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.509 HG22 ' O ' ' A' ' 31' ' ' PHE . 4.3 t -62.15 -27.25 68.81 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 120.915 0.388 . . . . 0.0 110.471 179.351 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -111.55 5.83 19.7 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.759 179.655 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 63.05 24.49 14.53 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 115.782 -0.645 . . . . 0.0 112.36 176.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 28.5 m -97.19 19.23 13.36 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.298 0.57 . . . . 0.0 110.279 177.246 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.537 ' HB3' ' HG2' ' A' ' 33' ' ' LYS . 11.8 pt-20 -62.14 -24.96 67.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.24 -0.891 . . . . 0.0 112.332 -173.604 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.447 ' O ' ' HB2' ' A' ' 43' ' ' PHE . 11.3 mp0 -51.61 -22.3 3.22 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -176.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.576 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 47.4 m-80 -71.65 -60.84 2.02 Favored 'General case' 0 C--O 1.242 0.676 0 CA-C-O 121.115 0.483 . . . . 0.0 110.901 -179.738 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.457 ' O ' HG13 ' A' ' 45' ' ' ILE . 8.4 tt -62.69 -41.02 90.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 179.37 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.457 ' OE1' ' HB2' ' A' ' 38' ' ' GLU . 0.9 OUTLIER -64.74 -27.0 68.61 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.068 176.227 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.576 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 77.6 t80 -58.85 -59.03 6.1 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 120.703 0.287 . . . . 0.0 110.536 178.061 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.451 ' CZ2' HD23 ' A' ' 19' ' ' LEU . 28.5 p-90 -74.34 -14.79 60.93 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 119.377 -0.929 . . . . 0.0 111.665 -177.162 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.457 HG13 ' O ' ' A' ' 41' ' ' ILE . 68.2 mt -71.16 -37.3 66.03 Favored 'Isoleucine or valine' 0 C--O 1.238 0.461 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 169.231 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.59 -27.04 68.68 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.961 175.473 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.442 ' SG ' ' HB2' ' A' ' 101' ' ' PHE . 53.1 t -62.44 -29.05 70.23 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.038 175.258 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.509 ' O ' ' HG2' ' A' ' 51' ' ' LYS . 19.1 mt-10 -72.31 -41.0 67.07 Favored 'General case' 0 N--CA 1.458 -0.058 0 N-CA-C 109.784 -0.451 . . . . 0.0 109.784 174.397 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -61.36 -26.38 67.79 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.025 0.44 . . . . 0.0 110.377 174.075 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -73.95 -46.14 45.89 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.984 177.4 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.509 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 64.3 pttt -70.2 -23.1 62.89 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 116.759 -0.2 . . . . 0.0 111.422 -175.459 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.478 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 19.3 ptmt -90.37 7.96 35.95 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -177.367 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 65.9 m -54.54 119.16 4.86 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 120.807 0.337 . . . . 0.0 110.443 178.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.14 -19.45 65.6 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.782 -175.673 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -125.4 148.47 16.88 Favored Glycine 0 C--N 1.331 0.304 0 C-N-CA 120.95 -0.643 . . . . 0.0 112.402 -177.231 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -67.93 -32.55 28.55 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.683 2.255 . . . . 0.0 111.987 -179.082 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -71.66 -34.48 69.77 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 177.734 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 56.6 tp60 -58.7 -32.45 69.18 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.123 178.745 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.498 HG22 ' HG2' ' A' ' 96' ' ' PRO . 33.9 mm -55.23 -45.44 77.54 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.496 175.668 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 40.5 m-70 -66.19 -40.92 90.76 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.115 -178.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 77.6 mt -63.91 -49.99 70.49 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.02 -178.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.561 ' HE2' ' HA ' ' A' ' 62' ' ' LYS . 9.0 mmpt? -65.55 -42.98 91.26 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.833 -178.701 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.58 -46.78 86.21 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.804 179.648 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 6.7 tmtt? -63.39 -37.04 85.72 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.238 179.315 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.16 -51.91 65.93 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.561 179.054 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 72.6 mt -62.38 -36.01 72.51 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.193 178.46 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.587 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 74.3 t80 -58.48 -63.89 1.12 Allowed 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.489 178.849 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -54.72 -40.12 68.91 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.984 -174.608 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 56.3 tttm -96.41 -16.64 21.11 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 112.478 0.547 . . . . 0.0 112.478 -168.085 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -135.02 -53.37 0.8 Allowed 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 112.705 0.632 . . . . 0.0 112.705 -174.522 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.587 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 48.5 mm -67.41 -41.69 86.48 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 CA-C-O 120.618 0.247 . . . . 0.0 111.401 -170.047 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 51.2 tp60 -50.69 131.46 25.66 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.509 -178.358 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 20.4 m -54.82 -31.49 59.25 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.808 -174.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -114.9 32.52 5.97 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.049 0.452 . . . . 0.0 110.749 -178.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.546 ' HB3' ' HA ' ' A' ' 78' ' ' GLU . . . -60.44 158.61 28.53 Favored Pre-proline 0 CA--C 1.537 0.481 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.056 179.108 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.486 ' HD2' ' HB1' ' A' ' 75' ' ' ALA . 2.0 Cg_endo -44.05 -54.31 3.96 Favored 'Trans proline' 0 C--N 1.358 1.031 0 C-N-CA 123.672 2.915 . . . . 0.0 113.458 -175.579 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.411 ' O ' ' HG2' ' A' ' 78' ' ' GLU . 43.2 mtpt -107.16 -19.28 13.65 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 110.313 -0.254 . . . . 0.0 110.313 175.16 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.546 ' HA ' ' HB3' ' A' ' 75' ' ' ALA . 10.0 pt-20 52.89 162.84 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.969 1.308 . . . . 0.0 113.282 -179.855 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 64.5 t -126.87 137.57 57.46 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 CA-C-N 114.856 -1.066 . . . . 0.0 108.835 174.572 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.413 ' HB2' HD21 ' A' ' 111' ' ' LEU . 17.6 m120 -74.63 20.56 0.12 Allowed 'General case' 0 N--CA 1.469 0.513 0 O-C-N 123.272 0.358 . . . . 0.0 111.851 -176.34 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.433 ' O ' ' HE3' ' A' ' 86' ' ' LYS . 61.9 tp -50.07 134.42 21.93 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.487 175.034 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -47.43 140.59 5.6 Favored 'General case' 0 N--CA 1.469 0.475 0 O-C-N 123.475 0.484 . . . . 0.0 111.974 -177.744 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 99.1 m-85 -58.25 -48.27 80.97 Favored 'General case' 0 C--N 1.333 -0.109 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.705 -177.375 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . 0.406 ' O ' ' HB3' ' A' ' 87' ' ' GLU . 83.1 t60 -59.89 -37.31 79.02 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.048 -179.478 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 25.8 m -67.88 -49.94 59.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.872 -178.547 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.55 ' O ' HG23 ' A' ' 90' ' ' THR . 17.9 ptpt -72.55 -21.33 61.18 Favored 'General case' 0 C--O 1.227 -0.112 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.451 179.278 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.406 ' HB3' ' O ' ' A' ' 84' ' ' HIS . 14.4 tp10 -57.89 -55.23 37.52 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 173.641 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 59.7 t -52.84 -49.37 47.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.926 176.47 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 68.3 mt -58.27 -44.14 87.49 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.853 -177.822 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.55 HG23 ' O ' ' A' ' 86' ' ' LYS . 64.2 p -61.28 -29.21 69.72 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 120.791 0.329 . . . . 0.0 110.824 -177.618 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 56.5 m-80 -88.51 -37.81 15.46 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.669 179.678 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 61.9 p -100.53 11.45 39.44 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 112.011 0.375 . . . . 0.0 112.011 -174.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.3 tp -58.37 -24.58 25.17 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 CA-C-O 120.984 0.421 . . . . 0.0 111.391 -178.457 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 8.8 t -76.45 -15.78 59.83 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.588 -179.199 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 16.3 pt20 -135.41 58.69 27.18 Favored Pre-proline 0 CA--C 1.538 0.496 0 CA-C-O 120.903 0.382 . . . . 0.0 110.979 -177.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . 0.498 ' HG2' HG22 ' A' ' 59' ' ' ILE . 85.3 Cg_endo -81.62 122.47 4.0 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.656 2.237 . . . . 0.0 112.401 -176.309 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 11.5 m -71.42 161.7 30.62 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.197 177.762 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -51.21 -38.74 54.09 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 122.502 0.321 . . . . 0.0 111.654 -177.611 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 28.7 m-70 -113.21 38.88 2.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.075 0.464 . . . . 0.0 110.884 178.545 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 17.2 p -62.29 -53.07 60.48 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.254 0.55 . . . . 0.0 110.476 177.031 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.442 ' HB2' ' SG ' ' A' ' 47' ' ' CYS . 94.8 m-85 -74.11 -0.98 18.27 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.358 -179.801 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . 0.502 ' O ' ' HB3' ' A' ' 105' ' ' GLN . 14.6 t70 -61.71 -33.25 73.69 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.13 0.49 . . . . 0.0 109.966 178.621 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.29 -41.57 96.82 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.896 174.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.94 -29.6 69.51 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.198 177.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.502 ' HB3' ' O ' ' A' ' 102' ' ' ASP . 21.7 tm0? -56.03 -52.29 64.77 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.922 177.005 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 31.5 t -62.06 -38.47 88.92 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.559 179.813 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . 0.416 ' O ' ' HG2' ' A' ' 110' ' ' GLN . 6.2 mmp_? -61.3 -54.43 44.05 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.951 179.315 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 96.8 t -64.56 -36.63 77.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 121.309 0.576 . . . . 0.0 110.369 -179.31 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -55.99 -50.57 70.46 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.737 176.477 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . 0.416 ' HG2' ' O ' ' A' ' 107' ' ' ARG . 3.5 pt20 -73.76 -29.21 62.08 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 120.821 0.344 . . . . 0.0 110.551 -179.205 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.44 ' O ' ' HG2' ' A' ' 114' ' ' GLN . 57.0 tp -62.85 -43.52 98.58 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.494 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 58.8 mtm -75.63 -35.44 60.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.052 177.41 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . 0.439 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 3.7 tm-20 -52.31 -53.46 44.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.938 -177.811 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . 0.44 ' HG2' ' O ' ' A' ' 111' ' ' LEU . 4.3 pt20 -54.29 -17.04 2.52 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 112.732 0.641 . . . . 0.0 112.732 -172.831 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 42.4 m-20 -124.88 -68.16 0.87 Allowed 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.225 0.536 . . . . 0.0 110.795 178.515 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 5.0 m -59.09 -29.7 67.55 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.422 -0.808 . . . . 0.0 112.455 -171.309 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . 0.439 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 19.6 t80 -65.87 -59.07 4.22 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 120.55 0.214 . . . . 0.0 110.93 -177.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 1.3 p -60.97 -38.35 85.65 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.657 0.265 . . . . 0.0 110.926 179.278 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 78.9 mtp85 -58.15 -42.31 85.62 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.001 0.429 . . . . 0.0 110.01 175.194 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -64.14 -38.99 93.03 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.416 178.045 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 92.8 mt -66.76 -21.62 66.05 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.232 -179.217 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? -108.75 -0.94 19.72 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 120.662 0.268 . . . . 0.0 111.488 179.442 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 80.4 p -66.3 152.69 44.42 Favored 'General case' 0 C--O 1.237 0.407 0 O-C-N 122.256 -0.277 . . . . 0.0 110.519 179.613 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -54.47 -31.88 56.61 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 175.717 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.558 ' O ' ' HG ' ' A' ' 129' ' ' LEU . 72.9 mt -55.66 -59.06 2.96 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.174 0 CA-C-N 115.177 -0.919 . . . . 0.0 110.678 178.518 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 58.4 t80 -59.53 -43.94 93.33 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.021 -174.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -66.44 -31.55 72.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.794 179.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -71.04 -35.41 71.96 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.015 177.656 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.558 ' HG ' ' O ' ' A' ' 125' ' ' ILE . 47.8 mt -59.88 -40.46 88.77 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.915 178.358 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' MET . . . . . . . . . . . . . 23.5 mmt . . . . . 0 C--O 1.234 0.289 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.835 175.924 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.634 HG11 HD13 ' A' ' 129' ' ' LEU . 2.9 p . . . . . 0 CA--C 1.531 0.25 0 CA-C-O 121.359 0.599 . . . . 0.0 111.792 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.417 ' OG ' ' HD2' ' A' ' 5' ' ' PRO . 47.1 t -100.24 156.58 35.11 Favored Pre-proline 0 C--N 1.326 -0.415 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 170.817 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.417 ' HD2' ' OG ' ' A' ' 4' ' ' SER . 72.3 Cg_exo -42.62 -37.88 5.9 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 122.519 2.146 . . . . 0.0 112.73 176.8 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.564 ' O ' HG22 ' A' ' 9' ' ' VAL . 7.0 mm-40 -67.4 -43.12 82.06 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 121.603 0.716 . . . . 0.0 110.16 176.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.518 ' HB3' HG23 ' A' ' 3' ' ' VAL . 14.8 tp10 -67.46 -23.31 65.49 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.379 -0.828 . . . . 0.0 109.973 178.922 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -73.9 -47.22 39.45 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.792 178.644 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.564 HG22 ' O ' ' A' ' 6' ' ' GLU . 19.3 m -63.42 -24.13 35.09 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 C-N-CA 121.091 -0.244 . . . . 0.0 110.527 179.745 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.511 ' O ' ' HD2' ' A' ' 17' ' ' LYS . 32.6 mmtp -51.99 -46.91 65.06 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 121.343 0.592 . . . . 0.0 110.224 172.175 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 33.5 m0 -64.51 -28.22 69.51 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.563 -176.163 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -74.62 -11.04 83.12 Favored Glycine 0 N--CA 1.452 -0.256 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.401 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -80.98 -24.77 37.79 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 120.831 0.348 . . . . 0.0 110.543 179.112 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 45.8 t -172.57 131.88 0.57 Allowed 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.661 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -61.52 -25.5 67.32 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.649 174.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -68.65 -35.71 77.62 Favored 'General case' 0 N--CA 1.461 0.114 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.007 176.129 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.511 ' HD2' ' O ' ' A' ' 10' ' ' LYS . 35.6 ttmt -70.25 -36.92 74.78 Favored 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 115.998 -0.546 . . . . 0.0 109.928 179.313 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 48.8 tp -58.43 -45.89 87.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.201 174.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.7 mp -74.78 -30.64 61.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.932 -177.311 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 69.7 p -78.35 -27.19 46.95 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 120.945 0.402 . . . . 0.0 110.364 178.787 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 24.0 t-80 -72.75 110.3 6.98 Favored 'General case' 0 C--O 1.221 -0.4 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 176.305 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.18 -53.49 16.67 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 121.2 0.524 . . . . 0.0 111.019 -175.238 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -68.81 -20.66 64.33 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.827 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -78.56 -53.41 4.68 Favored Glycine 0 C--N 1.332 0.329 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.795 -179.461 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.9 tt -51.71 -38.4 54.99 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 123.223 0.609 . . . . 0.0 110.682 174.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.634 ' O ' ' HG2' ' A' ' 30' ' ' ARG . 10.5 tp10 -62.35 -53.67 51.65 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.88 176.847 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -55.37 -44.97 76.55 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-O 121.293 0.568 . . . . 0.0 110.932 179.772 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . 0.416 ' CE2' HD22 ' A' ' 32' ' ' LEU . 75.3 t80 -64.2 -44.14 92.89 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.872 -179.274 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.604 HG22 ' O ' ' A' ' 26' ' ' GLU . 4.0 t -67.01 -27.79 67.71 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.067 -177.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.634 ' HG2' ' O ' ' A' ' 26' ' ' GLU . 35.0 mmt180 -54.95 -52.89 61.6 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 173.305 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.581 ' O ' HG22 ' A' ' 34' ' ' THR . 84.3 t80 -68.21 -45.59 72.94 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.945 -179.141 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.416 HD22 ' CE2' ' A' ' 28' ' ' PHE . 21.5 tp -63.56 -29.85 71.04 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.003 0.43 . . . . 0.0 111.179 -175.344 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.433 ' HE2' ' OG1' ' A' ' 29' ' ' THR . 67.6 mttm -80.75 -9.69 59.78 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.559 179.295 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.581 HG22 ' O ' ' A' ' 31' ' ' PHE . 0.7 OUTLIER -84.13 -28.28 27.56 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 177.955 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -98.41 4.67 48.47 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.716 178.113 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 87.1 m-85 65.16 18.01 11.27 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.811 176.051 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 25.5 m -97.21 15.01 23.97 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 121.045 0.45 . . . . 0.0 110.641 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -56.08 -24.23 38.77 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.338 -179.587 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -45.62 -43.6 12.43 Favored 'General case' 0 C--O 1.225 -0.203 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.628 176.7 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.523 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 2.0 m-20 -57.67 -59.24 5.5 Favored 'General case' 0 C--O 1.245 0.837 0 CA-C-O 121.448 0.642 . . . . 0.0 112.007 -175.288 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.473 ' O ' HG13 ' A' ' 45' ' ' ILE . 13.2 tt -61.64 -42.4 94.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.043 -175.807 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.473 ' HA ' ' HB ' ' A' ' 45' ' ' ILE . 49.3 mt-10 -78.96 -10.01 59.69 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.069 -178.943 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.523 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 72.5 t80 -67.73 -59.28 3.44 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 175.311 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.442 ' HA ' ' SG ' ' A' ' 47' ' ' CYS . 32.1 p-90 -76.06 -19.01 58.97 Favored 'General case' 0 N--CA 1.463 0.215 0 C-N-CA 119.887 -0.725 . . . . 0.0 111.414 -178.861 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.473 HG13 ' O ' ' A' ' 41' ' ' ILE . 54.7 mt -62.92 -39.53 85.43 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 169.901 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.24 -35.64 81.67 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.214 175.408 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.442 ' SG ' ' HA ' ' A' ' 44' ' ' TRP . 67.4 m -63.94 -33.55 75.97 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.32 177.03 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.662 ' O ' ' HG2' ' A' ' 51' ' ' LYS . 9.0 mm-40 -66.72 -52.89 39.29 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 173.4 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -53.31 -26.31 18.22 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.349 0.595 . . . . 0.0 110.325 178.265 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.404 ' HD1' ' HD3' ' A' ' 62' ' ' LYS . 41.8 t80 -74.28 -40.3 62.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.334 177.48 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.662 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 59.9 pttt -66.94 -18.13 65.24 Favored 'General case' 0 N--CA 1.471 0.591 0 O-C-N 121.993 -0.442 . . . . 0.0 110.777 -178.302 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -72.7 -27.3 61.99 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.859 177.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 67.1 p -59.73 124.04 18.87 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 121.092 0.472 . . . . 0.0 110.419 -177.374 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.98 -14.23 16.03 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.752 -177.892 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -83.39 119.39 4.88 Favored Glycine 0 N--CA 1.448 -0.505 0 CA-C-N 115.934 -0.576 . . . . 0.0 112.03 -179.082 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_exo -53.15 -33.54 64.68 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.86 2.373 . . . . 0.0 112.014 179.062 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 20.3 mp0 -71.67 -39.66 70.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.614 178.495 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 55.4 tp60 -61.83 -40.55 95.66 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.26 -178.341 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 44.4 mm -49.53 -51.35 15.12 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.248 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.972 -178.853 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 79.2 m-70 -64.43 -55.1 23.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.692 -0.686 . . . . 0.0 111.688 -175.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.502 HD12 ' N ' ' A' ' 62' ' ' LYS . 4.3 pp -71.22 -30.16 66.01 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.805 -173.277 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.502 ' N ' HD12 ' A' ' 61' ' ' LEU . 57.6 tttp -74.29 -43.4 56.96 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 -179.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.33 -36.05 82.41 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.252 176.033 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 6.7 tmtt? -63.18 -36.76 84.71 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 115.659 -0.7 . . . . 0.0 109.971 179.026 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -66.87 -55.42 14.84 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.482 177.585 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 66.9 mt -56.31 -35.68 43.93 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-O 121.365 0.602 . . . . 0.0 110.238 178.431 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 76.2 t80 -56.08 -56.85 15.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.071 -0.968 . . . . 0.0 110.52 178.11 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.486 ' HA ' ' HB2' ' A' ' 72' ' ' GLN . 34.3 mt-10 -77.88 -18.22 56.43 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.543 -174.638 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -82.06 -36.73 27.38 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.132 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -126.47 -51.55 1.5 Allowed 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 112.135 0.421 . . . . 0.0 112.135 -174.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 33.7 mm -71.98 -15.51 18.11 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.373 0 CA-C-O 121.063 0.459 . . . . 0.0 111.34 -171.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.486 ' HB2' ' HA ' ' A' ' 68' ' ' GLU . 16.5 tm0? -58.71 132.79 54.92 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.477 179.143 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.9 m -55.05 -37.3 66.55 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 112.613 0.597 . . . . 0.0 112.613 -170.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -84.02 -67.35 0.8 Allowed 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 110.116 -0.327 . . . . 0.0 110.116 179.109 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.404 ' HB3' ' HA ' ' A' ' 78' ' ' GLU . . . 64.06 156.84 0.12 Allowed Pre-proline 0 CA--C 1.539 0.53 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.682 178.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -73.31 -7.29 20.23 Favored 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 122.438 2.092 . . . . 0.0 112.586 -178.616 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.446 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 46.6 tttm -145.28 7.92 1.18 Allowed 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.591 -177.873 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.404 ' HA ' ' HB3' ' A' ' 75' ' ' ALA . 12.3 pt-20 38.4 86.24 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.65 0.78 . . . . 0.0 112.266 -174.596 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.425 HG12 ' H ' ' A' ' 81' ' ' LEU . 54.3 t -56.28 132.91 20.47 Favored 'Isoleucine or valine' 0 C--O 1.232 0.16 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.291 -179.376 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 43.9 m-80 -76.25 14.99 0.63 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 116.232 -0.44 . . . . 0.0 112.178 -173.31 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.425 ' H ' HG12 ' A' ' 79' ' ' VAL . 57.7 tp -62.22 133.81 55.68 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 175.537 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -61.36 167.62 3.15 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-O 121.168 0.509 . . . . 0.0 111.785 -176.356 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 92.9 t80 -69.74 -43.97 71.22 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.162 -177.211 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . 0.469 ' O ' HG23 ' A' ' 88' ' ' VAL . 80.6 t60 -58.83 -51.83 68.32 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.446 -174.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 43.7 m -63.7 -42.76 97.93 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.519 -176.001 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 8.0 ptpp? -67.31 -33.03 74.42 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 120.586 -0.445 . . . . 0.0 109.984 179.236 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -61.86 -45.53 93.37 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.223 0.535 . . . . 0.0 109.898 177.554 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.469 HG23 ' O ' ' A' ' 84' ' ' HIS . 88.2 t -54.86 -43.14 66.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.976 176.583 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 72.4 mt -65.44 -43.76 94.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.886 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 39.9 p -63.72 -25.05 68.02 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 111.683 0.253 . . . . 0.0 111.683 -176.525 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 60.5 m-80 -90.43 -22.94 21.18 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 120.706 0.289 . . . . 0.0 111.16 177.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 29.3 t -100.24 -5.48 27.51 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.714 -0.221 . . . . 0.0 111.348 -177.373 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 9.9 tp -62.68 -23.55 33.05 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 CA-C-N 116.683 -0.235 . . . . 0.0 111.608 -175.819 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 6.8 t -58.6 -49.42 77.52 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-O 120.737 0.304 . . . . 0.0 110.88 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 21.6 mt-30 -139.43 81.53 20.26 Favored Pre-proline 0 C--O 1.235 0.316 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 178.352 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -83.1 162.5 15.52 Favored 'Trans proline' 0 CA--C 1.532 0.414 0 C-N-CA 122.834 2.356 . . . . 0.0 112.939 -176.281 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 77.1 p -90.35 174.78 7.39 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.119 174.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 9.2 mp -63.72 -11.86 29.66 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 120.828 0.347 . . . . 0.0 111.507 -178.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' HIS . . . . . 0.444 ' O ' ' HB2' ' A' ' 102' ' ' ASP . 0.2 OUTLIER -143.64 37.34 1.33 Allowed 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 -178.386 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 22.9 t -57.28 -22.86 44.53 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.969 -176.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.41 ' O ' ' HG3' ' A' ' 105' ' ' GLN . 82.8 m-85 -88.93 15.37 8.62 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.797 0.332 . . . . 0.0 110.616 -179.841 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . 0.544 ' HA ' ' NE2' ' A' ' 105' ' ' GLN . 20.5 t70 -54.67 -53.12 58.97 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.75 -173.768 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.449 ' O ' ' HG2' ' A' ' 107' ' ' ARG . . . -59.98 -37.51 79.84 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 120.993 0.425 . . . . 0.0 111.002 178.807 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.74 -37.73 85.33 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.012 -178.096 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.544 ' NE2' ' HA ' ' A' ' 102' ' ' ASP . 29.4 mt-30 -54.86 -57.02 13.28 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-O 121.286 0.565 . . . . 0.0 109.587 177.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . 0.688 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 20.0 m -55.94 -45.58 78.77 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 114.735 -1.12 . . . . 0.0 110.828 -176.86 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . 0.501 ' O ' ' HG ' ' A' ' 111' ' ' LEU . 39.8 mmt180 -54.08 -57.97 9.08 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.974 0.416 . . . . 0.0 111.004 -179.56 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.562 ' HA ' HD12 ' A' ' 111' ' ' LEU . 46.3 t -63.17 -33.45 60.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.566 -178.002 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . 0.546 ' HA ' ' HE1' ' A' ' 112' ' ' MET . 48.3 t80 -59.14 -45.33 91.22 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.762 177.655 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . 0.688 ' HG3' ' O ' ' A' ' 106' ' ' SER . 29.7 mt-30 -61.07 -40.92 95.52 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.528 0.68 . . . . 0.0 109.684 178.063 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.562 HD12 ' HA ' ' A' ' 108' ' ' VAL . 94.4 mt -58.04 -54.12 50.5 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.538 -1.21 . . . . 0.0 112.432 -172.296 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . 0.546 ' HE1' ' HA ' ' A' ' 109' ' ' TYR . 0.0 OUTLIER -85.59 -12.38 51.68 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 119.864 -0.734 . . . . 0.0 110.922 -177.654 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . 0.676 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 38.4 tt0 -63.71 -66.69 0.51 Allowed 'General case' 0 C--O 1.233 0.231 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 174.074 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -50.91 -32.32 20.32 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.676 -177.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . 0.565 ' O ' ' HD3' ' A' ' 119' ' ' ARG . 25.1 t70 -97.84 -76.5 0.52 Allowed 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.612 -176.68 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 23.0 t -62.8 -38.18 89.67 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -171.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . 0.676 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 31.0 t80 -64.98 -38.88 92.42 Favored 'General case' 0 N--CA 1.468 0.454 0 O-C-N 122.287 -0.258 . . . . 0.0 111.157 -176.471 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 27.8 p -67.73 -42.03 82.51 Favored 'General case' 0 C--O 1.24 0.568 0 CA-C-O 121.063 0.459 . . . . 0.0 110.541 179.41 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . 0.565 ' HD3' ' O ' ' A' ' 115' ' ' ASP . 10.5 mpt_? -66.54 -34.84 78.79 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.005 176.267 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 86.3 t80 -60.83 -42.27 97.43 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 175.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.429 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 91.3 mt -61.87 -27.82 69.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.607 177.424 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . 0.456 ' HD3' ' HA ' ' A' ' 122' ' ' LYS . 64.0 mmtt -110.03 18.34 20.14 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 112.379 0.511 . . . . 0.0 112.379 179.262 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 80.2 p -79.77 147.72 31.74 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 171.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -55.22 -29.87 58.83 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 121.066 0.46 . . . . 0.0 110.39 176.516 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.451 ' O ' ' HG ' ' A' ' 129' ' ' LEU . 2.1 mp -60.19 -57.72 10.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.482 179.4 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 72.9 t80 -65.52 -39.34 91.71 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.664 -177.486 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.401 HD13 ' HA ' ' A' ' 127' ' ' LEU . 3.8 mm? -63.77 -33.41 75.59 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.854 178.136 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -67.83 -34.53 76.9 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.065 0.459 . . . . 0.0 110.288 176.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.634 HD13 HG11 ' A' ' 3' ' ' VAL . 73.3 mt -76.41 -17.53 59.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.451 178.159 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' MET . . . . . 0.408 ' HE1' HG13 ' A' ' 9' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--N 1.332 -0.172 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.829 178.493 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.464 HG23 ' HB3' ' A' ' 7' ' ' GLU . 4.0 p . . . . . 0 N--CA 1.454 -0.263 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 16.8 m -104.37 150.94 38.99 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 116.245 -0.434 . . . . 0.0 109.938 -179.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.414 ' HA ' ' HB3' ' A' ' 8' ' ' ALA . 1.2 Cg_endo -45.95 -31.78 8.7 Favored 'Trans proline' 0 C--N 1.353 0.797 0 C-N-CA 123.325 2.684 . . . . 0.0 112.667 178.98 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.462 ' O ' ' HD3' ' A' ' 10' ' ' LYS . 9.1 tp10 -55.74 -52.52 63.63 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-O 121.343 0.592 . . . . 0.0 110.144 175.649 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.464 ' HB3' HG23 ' A' ' 3' ' ' VAL . 9.5 tp10 -69.23 -32.67 72.07 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.727 -0.669 . . . . 0.0 109.967 179.04 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.414 ' HB3' ' HA ' ' A' ' 5' ' ' PRO . . . -62.66 -46.64 87.27 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.073 -179.348 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.424 HG22 ' O ' ' A' ' 6' ' ' GLU . 32.2 m -67.83 -27.93 39.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.313 0 CA-C-O 120.824 0.345 . . . . 0.0 110.198 179.167 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.462 ' HD3' ' O ' ' A' ' 6' ' ' GLU . 13.9 mptt -69.25 -36.52 77.25 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.027 173.244 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.406 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 49.7 m0 -60.83 -36.82 80.08 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 172.05 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -70.58 2.26 16.99 Favored Glycine 0 CA--C 1.521 0.418 0 CA-C-N 114.91 -1.041 . . . . 0.0 113.711 -177.063 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.407 ' HG3' ' O ' ' A' ' 10' ' ' LYS . 2.8 pp20? -127.74 -3.09 5.96 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 117.394 0.597 . . . . 0.0 111.499 177.326 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 74.0 m -153.34 105.78 2.89 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 120.667 0.27 . . . . 0.0 111.005 177.781 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.42 ' O ' ' HB3' ' A' ' 18' ' ' LEU . 30.9 t80 -58.33 -36.77 73.9 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 121.031 0.443 . . . . 0.0 109.932 178.292 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -57.43 -45.41 84.7 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.03 176.48 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.413 ' HB2' ' HE3' ' A' ' 17' ' ' LYS . 37.5 ttmt -65.07 -36.47 84.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.975 -178.513 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.42 ' HB3' ' O ' ' A' ' 15' ' ' PHE . 36.0 tp -59.73 -51.49 69.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.671 175.305 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 21.4 tp -80.49 -24.05 39.72 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.786 -171.704 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 70.7 m -69.57 -27.02 64.77 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.072 0.463 . . . . 0.0 110.629 178.11 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -80.15 129.73 34.71 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.568 174.067 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 10.6 tpt180 -59.47 -32.99 70.76 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 174.4 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -57.57 -50.82 71.85 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.536 176.655 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -70.78 -41.3 63.62 Favored Glycine 0 N--CA 1.449 -0.46 0 CA-C-N 115.014 -0.993 . . . . 0.0 112.217 -177.595 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 9.6 tt -60.21 -47.34 86.38 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 122.783 0.433 . . . . 0.0 110.226 179.572 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.61 ' O ' ' HG2' ' A' ' 30' ' ' ARG . 9.3 tp10 -65.09 -49.35 70.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.827 -179.339 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -59.74 -42.11 92.42 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.071 -179.646 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 76.9 t80 -68.64 -48.38 64.19 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.059 -176.449 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.422 HG22 ' O ' ' A' ' 26' ' ' GLU . 14.6 t -60.53 -36.01 77.36 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 120.695 0.283 . . . . 0.0 110.544 -177.403 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.61 ' HG2' ' O ' ' A' ' 26' ' ' GLU . 21.6 mmt180 -62.53 -52.8 62.01 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.025 0.441 . . . . 0.0 110.326 178.735 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.571 ' O ' HG22 ' A' ' 34' ' ' THR . 84.5 t80 -65.31 -31.03 71.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.609 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 17.7 tp -74.03 -26.77 60.61 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.435 -179.199 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.412 ' HG3' ' O ' ' A' ' 29' ' ' THR . 67.3 mttm -76.95 -34.77 57.59 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.26 178.839 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.571 HG22 ' O ' ' A' ' 31' ' ' PHE . 7.2 t -71.17 -8.52 54.05 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.785 0.326 . . . . 0.0 111.095 -177.013 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -119.24 17.34 13.13 Favored 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 173.142 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 33.4 p90 43.41 29.94 0.28 Allowed 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.171 0.988 . . . . 0.0 112.822 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 31.5 m -95.63 8.88 42.13 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.184 176.375 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -56.8 -21.06 25.93 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.066 -179.205 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.435 ' HG3' ' N ' ' A' ' 40' ' ' ASN . 8.9 pt-20 -49.62 -37.24 27.21 Favored 'General case' 0 C--O 1.225 -0.216 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.271 177.628 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.435 ' N ' ' HG3' ' A' ' 39' ' ' GLU . 46.9 m-80 -60.77 -61.31 2.68 Favored 'General case' 0 C--O 1.24 0.605 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.803 -174.215 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 13.0 tt -64.47 -34.02 66.75 Favored 'Isoleucine or valine' 0 C--O 1.235 0.309 0 CA-C-O 121.053 0.454 . . . . 0.0 110.019 -177.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.454 ' O ' HG22 ' A' ' 45' ' ' ILE . 6.3 tp10 -72.74 -25.94 61.39 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.166 -179.309 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.435 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 71.9 t80 -64.63 -65.1 0.72 Allowed 'General case' 0 C--O 1.236 0.384 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.713 179.136 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 32.6 p-90 -78.08 -9.72 59.28 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 119.747 -0.781 . . . . 0.0 112.385 -173.364 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.614 ' O ' ' HG3' ' A' ' 48' ' ' GLU . 9.5 tt -75.17 -31.54 24.76 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.201 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 169.502 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.28 -29.31 69.51 Favored 'General case' 0 C--O 1.232 0.137 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 172.472 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.575 ' SG ' ' HB2' ' A' ' 101' ' ' PHE . 52.7 t -66.22 -32.73 74.33 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.349 176.309 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.614 ' HG3' ' O ' ' A' ' 45' ' ' ILE . 0.0 OUTLIER -82.91 -28.79 29.69 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 177.379 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.441 ' O ' ' HB2' ' A' ' 52' ' ' LYS . 15.6 t70 -58.41 -27.61 64.45 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.742 0.782 . . . . 0.0 109.094 167.386 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.502 ' HB3' ' O ' ' A' ' 47' ' ' CYS . 42.4 t80 -79.3 -30.11 42.75 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 114.87 -1.059 . . . . 0.0 111.211 175.416 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.606 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 10.0 ptmt -60.74 -22.79 64.38 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 174.792 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.441 ' HB2' ' O ' ' A' ' 49' ' ' ASP . 14.0 mptt -72.47 56.79 0.37 Allowed 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.311 168.661 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.405 ' HB2' ' HD3' ' A' ' 62' ' ' LYS . 48.1 t -141.7 94.04 2.63 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.939 0.4 . . . . 0.0 109.939 175.159 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.63 -6.88 59.56 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.836 -179.757 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -106.8 123.19 7.24 Favored Glycine 0 CA--C 1.519 0.302 0 CA-C-O 119.735 -0.48 . . . . 0.0 111.916 -179.597 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_exo -56.39 -26.56 63.28 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.721 2.28 . . . . 0.0 112.507 179.714 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 30.5 mm-40 -71.49 -45.46 62.45 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 174.458 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 75.3 mm-40 -59.23 -31.75 69.35 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.06 179.342 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.4 HG23 ' HZ ' ' A' ' 50' ' ' PHE . 37.2 mm -50.9 -54.43 10.26 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.115 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.614 176.099 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 37.5 m-70 -65.86 -36.5 83.62 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.84 -177.67 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 83.4 mt -68.73 -51.77 37.8 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.458 -176.459 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.405 ' HD3' ' HB2' ' A' ' 53' ' ' SER . 52.2 mtpt -71.39 -31.45 67.3 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.413 -177.65 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.72 -42.01 87.01 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 120.968 0.413 . . . . 0.0 110.06 174.415 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 22.5 tptp -59.52 -35.2 73.72 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.097 176.431 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -65.03 -57.2 9.27 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.584 176.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 65.3 mt -58.64 -33.33 48.43 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 CA-C-O 121.204 0.526 . . . . 0.0 110.337 179.209 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.538 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 50.5 t80 -55.86 -61.9 2.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.449 177.426 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -71.25 -31.27 67.33 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.728 -174.732 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -82.79 -25.4 32.79 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.755 -174.491 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 85.7 m-85 -133.56 -53.74 0.88 Allowed 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -174.608 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.538 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 50.0 mm -70.72 -29.54 38.39 Favored 'Isoleucine or valine' 0 C--O 1.238 0.492 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 -170.471 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -64.63 143.29 58.03 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.018 -173.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.8 m -63.19 -39.56 95.0 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.06 178.263 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -101.24 92.51 5.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.538 0.685 . . . . 0.0 109.708 172.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.503 ' HB3' ' HA ' ' A' ' 78' ' ' GLU . . . -123.27 161.33 45.82 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.2 -176.312 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.502 ' HD2' ' HB1' ' A' ' 75' ' ' ALA . 4.1 Cg_endo -45.63 -37.37 15.49 Favored 'Trans proline' 0 C--N 1.356 0.958 0 C-N-CA 123.451 2.767 . . . . 0.0 113.02 -178.143 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.41 ' HE2' ' HB3' ' A' ' 39' ' ' GLU . 8.7 ttpp -139.93 -3.43 1.43 Allowed 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.615 -0.266 . . . . 0.0 111.081 176.6 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.503 ' HA ' ' HB3' ' A' ' 75' ' ' ALA . 54.8 mt-10 60.94 157.27 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 121.457 0.646 . . . . 0.0 111.92 -176.138 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 68.0 t -119.94 144.84 27.34 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.494 175.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 39.1 m-80 -81.59 19.93 0.97 Allowed 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 111.981 0.363 . . . . 0.0 111.981 -176.109 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 28.0 tp -65.77 140.39 58.42 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 175.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.408 ' OD2' ' HB3' ' A' ' 84' ' ' HIS . 8.4 p-10 -64.29 156.66 28.26 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.139 0.495 . . . . 0.0 112.098 -171.749 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.422 ' HA ' ' HG2' ' A' ' 86' ' ' LYS . 96.8 m-85 -60.07 -40.43 89.47 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.059 -178.514 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . 0.467 ' O ' HG23 ' A' ' 88' ' ' VAL . 24.0 t60 -53.61 -56.3 18.34 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.314 -179.175 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.438 ' OG1' ' HG3' ' A' ' 107' ' ' ARG . 29.2 m -72.06 -42.41 66.27 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.856 -174.588 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.422 ' HG2' ' HA ' ' A' ' 83' ' ' PHE . 0.1 OUTLIER -65.76 -31.85 73.07 Favored 'General case' 0 N--CA 1.463 0.181 0 C-N-CA 120.753 -0.379 . . . . 0.0 110.203 -178.985 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -62.54 -47.93 81.73 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.328 0.585 . . . . 0.0 109.947 177.242 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.467 HG23 ' O ' ' A' ' 84' ' ' HIS . 98.1 t -53.7 -46.3 61.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.554 178.687 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 56.9 mt -72.42 -40.9 64.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.535 -176.566 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 22.0 p -62.87 -21.67 66.14 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.788 0.327 . . . . 0.0 111.25 -178.372 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 35.4 m-80 -96.46 -38.6 9.95 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.094 176.146 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 16.8 t -83.35 0.06 47.6 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.596 -0.274 . . . . 0.0 111.468 -175.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 8.0 tp -57.38 -26.59 26.59 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 CA-C-O 120.866 0.365 . . . . 0.0 111.628 -178.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.422 HG23 ' HG2' ' A' ' 95' ' ' GLN . 9.9 t -66.45 -28.2 68.42 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 120.978 0.418 . . . . 0.0 110.984 179.313 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.422 ' HG2' HG23 ' A' ' 94' ' ' THR . 22.7 pt20 -139.21 71.45 40.01 Favored Pre-proline 0 CA--C 1.534 0.355 0 CA-C-O 121.129 0.49 . . . . 0.0 110.548 -178.736 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -87.6 131.78 2.91 Favored 'Trans proline' 0 N--CA 1.459 -0.523 0 C-N-CA 122.735 2.29 . . . . 0.0 112.477 -178.886 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.471 ' N ' ' HB2' ' A' ' 100' ' ' SER . 37.9 p -83.52 171.77 13.04 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.411 174.59 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 36.9 tp -61.02 -26.03 67.32 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 121.266 0.555 . . . . 0.0 110.526 -178.791 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' HIS . . . . . 0.568 ' HB3' ' HB2' ' A' ' 102' ' ' ASP . 23.3 m-70 -119.74 34.37 5.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.522 177.171 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . 0.471 ' HB2' ' N ' ' A' ' 97' ' ' THR . 22.2 t -61.74 -31.81 72.01 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.32 177.337 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.575 ' HB2' ' SG ' ' A' ' 47' ' ' CYS . 88.0 m-85 -91.9 6.36 46.5 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.966 -178.77 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . 0.568 ' HB2' ' HB3' ' A' ' 99' ' ' HIS . 12.8 t70 -64.11 -41.65 97.17 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.117 0.484 . . . . 0.0 110.347 -177.178 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.445 ' O ' ' HG2' ' A' ' 107' ' ' ARG . . . -59.32 -43.3 92.68 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.179 176.254 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.0 -37.41 85.84 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.413 177.778 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 21.5 tm0? -57.86 -45.38 86.4 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.169 176.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . 0.674 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 47.7 t -60.15 -58.44 8.53 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.527 -0.761 . . . . 0.0 110.165 176.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . 0.446 ' O ' ' HG ' ' A' ' 111' ' ' LEU . 23.2 mmm180 -49.22 -55.42 12.62 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 120.945 0.402 . . . . 0.0 111.336 -177.864 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 74.6 t -57.44 -40.03 72.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.026 179.444 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . 0.514 ' HA ' ' HE2' ' A' ' 112' ' ' MET . 55.6 t80 -64.26 -37.35 87.16 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.772 178.714 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . 0.674 ' HG3' ' O ' ' A' ' 106' ' ' SER . 42.7 mt-30 -67.56 -42.1 83.15 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 178.24 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 107' ' ' ARG . 93.4 mt -59.71 -45.02 93.42 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.819 -1.082 . . . . 0.0 110.679 -179.171 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . 0.514 ' HE2' ' HA ' ' A' ' 109' ' ' TYR . 54.5 mtm -62.08 -41.34 98.07 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 176.811 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . 0.634 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 4.5 tm-20 -61.92 -71.03 0.16 Allowed 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.913 -176.169 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -57.69 -18.13 19.01 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -171.487 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . 0.468 ' O ' ' HD3' ' A' ' 119' ' ' ARG . 7.8 m-20 -118.26 -75.99 0.58 Allowed 'General case' 0 N--CA 1.463 0.201 0 N-CA-C 111.576 0.213 . . . . 0.0 111.576 179.075 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 17.6 m -58.56 -28.37 65.46 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -171.641 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . 0.634 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 68.4 t80 -78.11 -45.32 23.71 Favored 'General case' 0 C--N 1.333 -0.123 0 N-CA-C 110.694 -0.113 . . . . 0.0 110.694 -176.825 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . 0.55 HG23 ' HD2' ' A' ' 119' ' ' ARG . 11.5 t -66.62 -40.22 88.68 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-O 120.918 0.389 . . . . 0.0 110.151 178.294 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . 0.55 ' HD2' HG23 ' A' ' 118' ' ' THR . 3.1 mpt_? -61.53 -38.66 88.22 Favored 'General case' 0 N--CA 1.461 0.104 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 173.754 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . 0.48 ' HA ' ' HB3' ' A' ' 123' ' ' SER . 76.8 t80 -64.7 -36.16 83.39 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.322 177.38 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 89.9 mt -59.76 -28.99 67.87 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.646 0.26 . . . . 0.0 110.576 178.035 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . 0.451 ' HD3' ' HA ' ' A' ' 122' ' ' LYS . 31.1 mmtp -115.1 16.9 16.97 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 176.121 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . 0.48 ' HB3' ' HA ' ' A' ' 120' ' ' PHE . 83.6 p -70.42 141.48 52.12 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 173.408 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -55.88 -38.14 69.75 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.243 -178.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.476 ' O ' ' HG ' ' A' ' 129' ' ' LEU . 7.7 tp -65.09 -42.86 95.54 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.147 -179.318 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 73.6 t80 -69.62 -36.97 76.64 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.743 0.306 . . . . 0.0 110.684 -179.609 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 94.4 mt -66.39 -29.88 70.14 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 120.934 0.397 . . . . 0.0 110.019 177.3 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -65.53 -34.05 77.35 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.048 173.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.476 ' HG ' ' O ' ' A' ' 125' ' ' ILE . 55.2 mt -76.3 -29.95 57.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.592 177.325 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' MET . . . . . . . . . . . . . 4.7 mmt . . . . . 0 N--CA 1.47 0.533 0 CA-C-N 116.094 -0.503 . . . . 0.0 112.128 -179.451 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.451 HG11 ' CH2' ' A' ' 11' ' ' TRP . 8.6 p . . . . . 0 C--O 1.233 0.219 0 CA-C-O 120.968 0.413 . . . . 0.0 111.494 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.408 ' N ' HG22 ' A' ' 3' ' ' VAL . 36.9 m -66.06 132.06 94.56 Favored Pre-proline 0 CA--C 1.534 0.363 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.889 172.602 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_exo -49.14 -33.98 29.06 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 123.159 2.573 . . . . 0.0 113.433 -176.012 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.509 ' O ' ' HG2' ' A' ' 10' ' ' LYS . 42.1 mt-10 -61.76 -45.61 93.17 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-O 120.809 0.337 . . . . 0.0 110.803 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.407 ' O ' ' HB2' ' A' ' 10' ' ' LYS . 17.4 tp10 -70.22 -33.38 71.6 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.155 0.502 . . . . 0.0 109.7 177.814 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.21 -45.5 92.98 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.804 179.124 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 30.7 m -75.02 -19.06 16.28 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-O 120.758 0.313 . . . . 0.0 110.837 179.486 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.509 ' HG2' ' O ' ' A' ' 6' ' ' GLU . 72.0 mmtt -67.06 -29.1 68.79 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.513 173.274 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.451 ' CH2' HG11 ' A' ' 3' ' ' VAL . 54.2 m0 -62.08 -24.11 66.91 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.074 -179.28 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -65.59 -12.07 55.26 Favored Glycine 0 CA--C 1.521 0.424 0 C-N-CA 121.173 -0.537 . . . . 0.0 112.593 177.325 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -74.71 -49.67 20.31 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 120.718 0.294 . . . . 0.0 110.611 177.866 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 30.5 m -154.19 128.76 9.26 Favored 'General case' 0 C--O 1.24 0.575 0 CA-C-O 121.024 0.44 . . . . 0.0 111.639 -175.127 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.454 ' CD1' HD23 ' A' ' 18' ' ' LEU . 84.8 t80 -55.55 -26.84 45.55 Favored 'General case' 0 N--CA 1.461 0.111 0 CA-C-N 115.641 -0.708 . . . . 0.0 109.931 175.141 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -51.89 -55.39 20.43 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.377 -0.828 . . . . 0.0 111.168 177.243 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.485 ' HD2' ' O ' ' A' ' 10' ' ' LYS . 17.3 ptpt -71.94 -30.42 65.3 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 120.927 -0.309 . . . . 0.0 110.363 -176.616 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.454 HD23 ' CD1' ' A' ' 15' ' ' PHE . 51.6 tp -56.32 -51.93 66.43 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.068 -0.514 . . . . 0.0 109.98 175.052 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 51.4 tp -71.19 -35.26 71.51 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.86 -178.138 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.0 m -74.3 -22.26 59.36 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.878 -177.103 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.9 t-80 -90.61 117.66 29.45 Favored 'General case' 0 N--CA 1.462 0.134 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 -179.641 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.539 ' HD3' ' H ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -36.68 -53.46 0.9 Allowed 'General case' 0 N--CA 1.475 0.817 0 O-C-N 123.847 0.717 . . . . 0.0 111.852 -176.682 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -56.93 -45.36 82.8 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.77 -177.454 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -65.95 -44.64 91.31 Favored Glycine 0 C--N 1.333 0.372 0 CA-C-N 115.727 -0.669 . . . . 0.0 111.791 -179.198 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 8.0 tt -57.9 -44.84 87.03 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.888 0.375 . . . . 0.0 110.299 177.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -64.33 -46.43 83.54 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.555 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -63.76 -35.41 80.49 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 120.999 0.428 . . . . 0.0 110.504 179.597 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -71.0 -49.51 44.45 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.419 -0.809 . . . . 0.0 110.956 -176.393 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 9.1 t -62.86 -36.12 82.24 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 120.656 0.265 . . . . 0.0 110.704 -178.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 74.6 mtm180 -64.92 -38.94 92.63 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 120.731 0.3 . . . . 0.0 111.104 179.661 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.583 ' O ' HG22 ' A' ' 34' ' ' THR . 87.0 t80 -76.55 -50.69 13.3 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.055 0.455 . . . . 0.0 110.553 178.789 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 36.8 tp -58.36 -24.95 61.37 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.011 -178.495 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 24.0 ttmm -63.75 -33.22 75.16 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.599 -178.665 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.583 HG22 ' O ' ' A' ' 31' ' ' PHE . 6.2 t -68.82 -20.51 64.31 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 121.183 -0.207 . . . . 0.0 111.457 -174.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -105.03 -1.5 25.61 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.806 0.336 . . . . 0.0 110.463 177.755 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 61.62 18.99 10.05 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 115.734 -0.666 . . . . 0.0 112.306 175.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.3 m -84.05 2.92 36.9 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 121.077 0.465 . . . . 0.0 109.955 176.157 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -51.65 -21.99 3.07 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.252 -0.886 . . . . 0.0 112.709 -177.46 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -58.61 -17.27 20.69 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -176.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.461 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 20.7 p30 -67.78 -39.44 84.08 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 121.269 0.557 . . . . 0.0 110.044 175.329 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.461 ' HA ' ' CZ2' ' A' ' 44' ' ' TRP . 58.6 mt -65.53 -47.34 86.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.68 175.406 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.538 ' HA ' HG22 ' A' ' 45' ' ' ILE . 2.8 mp0 -64.51 -24.0 67.46 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.931 176.239 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.461 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 60.3 t80 -61.58 -62.91 1.48 Allowed 'General case' 0 C--O 1.237 0.445 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.464 179.728 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.461 ' CZ2' ' HA ' ' A' ' 41' ' ' ILE . 3.6 p-90 -82.78 -7.81 59.63 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 120.292 -0.563 . . . . 0.0 112.422 -177.678 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.538 HG22 ' HA ' ' A' ' 42' ' ' GLU . 5.5 tt -76.9 -30.37 18.2 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 171.377 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.25 -35.5 71.43 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.735 173.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.415 ' O ' ' HB3' ' A' ' 50' ' ' PHE . 71.3 m -63.88 -33.74 76.38 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.12 174.524 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.614 ' O ' ' HG3' ' A' ' 52' ' ' LYS . 3.5 tm-20 -63.59 -51.24 66.19 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 108.434 -0.951 . . . . 0.0 108.434 173.109 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.553 ' HA ' ' CD ' ' A' ' 52' ' ' LYS . 27.5 t70 -50.36 -31.98 16.12 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.601 176.447 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.415 ' HB3' ' O ' ' A' ' 47' ' ' CYS . 78.9 t80 -70.51 -43.82 68.87 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.548 -178.578 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.575 ' HE3' ' HG2' ' A' ' 48' ' ' GLU . 18.6 pttp -69.13 -16.58 63.69 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 120.89 0.376 . . . . 0.0 110.823 -177.502 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.614 ' HG3' ' O ' ' A' ' 48' ' ' GLU . 15.8 mtpp -75.78 -14.02 60.3 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.256 178.739 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 79.4 p -58.22 -47.83 82.27 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.254 -175.669 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 46.91 18.57 0.07 Allowed 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.285 1.034 . . . . 0.0 112.769 -179.413 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . 0.469 ' O ' HG12 ' A' ' 59' ' ' ILE . . . -129.89 123.34 4.02 Favored Glycine 0 C--N 1.331 0.251 0 N-CA-C 111.313 -0.715 . . . . 0.0 111.313 -179.121 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.402 ' O ' ' HB ' ' A' ' 59' ' ' ILE . 9.8 Cg_endo -48.9 -52.16 9.18 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 123.378 2.719 . . . . 0.0 112.851 -173.758 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 27.2 pt20 -63.17 -39.46 94.71 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 120.717 0.294 . . . . 0.0 111.085 -179.214 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -68.47 -26.51 65.52 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.395 -178.317 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.469 HG12 ' O ' ' A' ' 55' ' ' GLY . 38.4 mm -55.91 -49.81 72.78 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.213 0 CA-C-O 121.07 0.462 . . . . 0.0 110.169 175.36 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 63.4 m-70 -64.92 -35.29 80.69 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.375 -177.409 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 93.8 mt -73.13 -54.32 8.79 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.518 -176.364 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 32.4 mmtp -63.74 -35.67 81.36 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.539 0.209 . . . . 0.0 110.785 -179.459 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.47 -48.82 80.1 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.189 176.499 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 17.9 tppt? -57.26 -40.42 77.66 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.611 177.266 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.53 -64.05 1.08 Allowed 'General case' 0 C--O 1.234 0.238 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.795 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 64.7 mt -56.39 -36.82 48.32 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 CA-C-O 121.14 0.495 . . . . 0.0 110.542 -179.463 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.481 ' CE1' HG22 ' A' ' 90' ' ' THR . 8.3 t80 -54.55 -73.94 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.348 -179.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.405 ' HG3' ' CD2' ' A' ' 67' ' ' TYR . 52.7 mt-10 -75.68 -3.55 35.28 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 -172.686 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.5 tppt? -95.18 -34.89 12.08 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 120.981 -0.288 . . . . 0.0 110.677 177.654 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 72.8 m-85 -130.93 -52.74 1.05 Allowed 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -173.723 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.464 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 46.4 mm -61.0 -44.19 97.69 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 CA-C-O 121.146 0.498 . . . . 0.0 111.388 -171.883 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -69.12 135.35 50.59 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.606 -175.032 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 22.1 m -70.11 -31.88 69.64 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.541 0.686 . . . . 0.0 109.353 176.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -83.74 13.26 4.9 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.151 -0.931 . . . . 0.0 110.816 176.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.559 ' HB1' ' HD2' ' A' ' 76' ' ' PRO . . . -63.76 160.21 47.13 Favored Pre-proline 0 CA--C 1.532 0.286 0 CA-C-N 116.394 -0.367 . . . . 0.0 110.133 176.118 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . 0.559 ' HD2' ' HB1' ' A' ' 75' ' ' ALA . 8.7 Cg_endo -50.27 -30.07 25.09 Favored 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 123.005 2.47 . . . . 0.0 113.164 -174.935 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.508 ' HD2' ' O ' ' A' ' 78' ' ' GLU . 0.1 OUTLIER -146.1 8.47 1.08 Allowed 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 120.639 0.257 . . . . 0.0 111.155 177.781 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.556 ' HA ' ' HB3' ' A' ' 75' ' ' ALA . 9.8 pt-20 45.01 -172.98 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 124.715 1.206 . . . . 0.0 114.022 -179.871 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 54.3 t -153.99 139.54 11.02 Favored 'Isoleucine or valine' 0 C--O 1.237 0.408 0 CA-C-N 114.812 -1.086 . . . . 0.0 108.173 178.203 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 -70.39 88.04 0.64 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.637 0.732 . . . . 0.0 111.082 -179.074 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 14.0 tp -133.91 145.0 49.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 114.751 -1.113 . . . . 0.0 109.175 178.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -54.12 142.15 26.47 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 121.299 0.571 . . . . 0.0 112.256 -176.168 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 40.8 p90 -66.5 -43.51 85.13 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.109 -0.95 . . . . 0.0 111.789 -176.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . 0.421 ' O ' ' HB3' ' A' ' 87' ' ' GLU . 85.2 t60 -70.37 -30.41 67.33 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.109 0.481 . . . . 0.0 110.461 -175.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 47.3 m -64.82 -52.15 58.28 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.285 177.666 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.475 ' O ' HG23 ' A' ' 90' ' ' THR . 18.0 ptpt -70.64 -24.04 62.64 Favored 'General case' 0 C--O 1.226 -0.164 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.623 -178.697 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.421 ' HB3' ' O ' ' A' ' 84' ' ' HIS . 12.0 tp10 -54.17 -58.73 6.24 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-O 121.448 0.642 . . . . 0.0 110.014 173.406 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 61.4 t -56.09 -42.26 71.81 Favored 'Isoleucine or valine' 0 C--O 1.237 0.44 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.303 178.458 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.403 HG21 HG21 ' A' ' 71' ' ' ILE . 70.1 mt -60.71 -47.36 93.4 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.248 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.207 -179.231 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.481 HG22 ' CE1' ' A' ' 67' ' ' TYR . 60.3 p -59.57 -30.56 68.73 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 121.037 0.446 . . . . 0.0 110.8 -177.599 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 -87.01 -17.29 33.34 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 115.817 -0.629 . . . . 0.0 112.26 -175.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 43.3 p -121.66 3.6 10.11 Favored 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 -179.745 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.6 tp -61.53 -23.51 30.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 CA-C-O 120.776 0.322 . . . . 0.0 111.631 -175.79 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.416 HG23 ' HG3' ' A' ' 95' ' ' GLN . 9.7 t -67.28 -32.97 74.32 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.131 -178.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.416 ' HG3' HG23 ' A' ' 94' ' ' THR . 96.4 mt-30 -136.33 75.58 52.04 Favored Pre-proline 0 N--CA 1.464 0.274 0 N-CA-C 110.321 -0.251 . . . . 0.0 110.321 -178.603 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -92.76 176.45 1.62 Allowed 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 122.82 2.346 . . . . 0.0 112.713 179.13 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 75.4 p -117.31 178.28 4.43 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.426 175.519 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -57.19 -24.94 57.89 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 112.154 0.427 . . . . 0.0 112.154 -173.36 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 93.8 m-70 -138.93 31.17 2.22 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 112.365 0.506 . . . . 0.0 112.365 -177.024 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 66.0 m -62.08 -21.57 65.06 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 121.078 0.465 . . . . 0.0 110.941 175.221 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -81.82 8.2 10.83 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.374 -179.676 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -60.79 -37.99 83.8 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 120.629 0.252 . . . . 0.0 110.479 -177.664 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.45 -43.23 99.22 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.661 177.499 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.34 -46.54 79.82 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.507 179.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.443 ' HG2' ' HB3' ' A' ' 44' ' ' TRP . 46.4 mt-30 -60.29 -41.81 94.16 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.007 177.719 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . 0.675 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 45.7 t -55.82 -58.49 7.64 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.851 178.238 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 2.5 mmp_? -46.98 -59.05 3.37 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.584 -178.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.541 ' O ' ' HG3' ' A' ' 112' ' ' MET . 11.4 p -64.7 -33.35 62.7 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.552 -175.862 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 15.8 t80 -66.5 -43.54 85.02 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.2 -179.521 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . 0.675 ' HG3' ' O ' ' A' ' 106' ' ' SER . 31.1 mt-30 -62.7 -40.3 96.72 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 121.666 0.746 . . . . 0.0 109.014 177.599 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 89.7 mt -60.63 -41.0 94.01 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.531 -1.213 . . . . 0.0 110.415 176.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . 0.541 ' HG3' ' O ' ' A' ' 108' ' ' VAL . 46.2 mtm -60.87 -39.66 90.01 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 177.338 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . 0.593 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 43.9 tt0 -61.42 -65.97 0.61 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.918 0.39 . . . . 0.0 110.208 179.104 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . 0.412 ' HG2' ' O ' ' A' ' 110' ' ' GLN . 10.7 pt20 -75.07 16.0 0.36 Allowed 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -172.843 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -141.99 -65.44 0.42 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.724 0.297 . . . . 0.0 110.686 173.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 4.2 m -68.21 -38.35 81.82 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.391 -176.351 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . 0.593 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 36.1 t80 -71.51 -40.83 69.88 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 110.285 -0.265 . . . . 0.0 110.285 -175.027 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 29.4 p -63.39 -43.56 97.23 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 120.921 0.391 . . . . 0.0 110.239 177.678 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 69.0 mtp85 -60.0 -40.49 89.4 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.003 174.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 58.3 t80 -66.58 -34.15 77.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.204 179.243 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 95.6 mt -65.27 -26.3 68.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.949 0.404 . . . . 0.0 110.249 175.562 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . 0.631 ' HA ' ' HE2' ' A' ' 122' ' ' LYS . 11.4 mmpt? -88.58 -16.44 32.52 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.335 179.263 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 59.1 p -61.66 139.9 58.24 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 120.99 0.424 . . . . 0.0 111.198 -177.161 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 16.6 p-10 -62.37 -31.31 71.95 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.814 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -64.43 -45.26 96.35 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.393 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' TYR . . . . . 0.451 ' O ' ' HG2' ' A' ' 130' ' ' MET . 69.5 t80 -69.12 -43.18 74.95 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 120.786 0.326 . . . . 0.0 110.333 -179.488 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 99.4 mt -60.42 -35.99 77.11 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.496 178.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -63.72 -38.99 93.2 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.347 177.215 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 91.8 mt -70.54 -27.52 64.22 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.986 179.263 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' MET . . . . . 0.451 ' HG2' ' O ' ' A' ' 126' ' ' TYR . 30.1 mmt . . . . . 0 N--CA 1.463 0.204 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.223 179.113 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.46 HG11 HD22 ' A' ' 129' ' ' LEU . 7.0 p . . . . . 0 CA--C 1.533 0.305 0 CA-C-O 121.491 0.662 . . . . 0.0 112.749 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.426 ' H ' ' HB3' ' A' ' 7' ' ' GLU . 32.2 t -133.66 150.28 74.38 Favored Pre-proline 0 CA--C 1.534 0.351 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 173.686 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_exo -43.38 -40.74 10.05 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.905 2.404 . . . . 0.0 113.018 179.87 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.536 ' O ' HG22 ' A' ' 9' ' ' VAL . 37.6 tt0 -66.81 -39.55 87.76 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 121.146 0.498 . . . . 0.0 110.453 178.744 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.426 ' HB3' ' H ' ' A' ' 4' ' ' SER . 18.3 tp10 -63.04 -35.84 81.57 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.232 0.539 . . . . 0.0 109.557 177.267 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.88 -45.2 93.66 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.553 -0.748 . . . . 0.0 111.346 -178.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.536 HG22 ' O ' ' A' ' 6' ' ' GLU . 24.6 m -67.56 -26.41 35.47 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.293 0 CA-C-O 120.765 0.317 . . . . 0.0 110.589 179.877 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.523 ' HG2' ' O ' ' A' ' 6' ' ' GLU . 74.3 mmtt -65.95 -29.5 69.92 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.263 0.554 . . . . 0.0 110.145 174.692 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 36.4 m0 -79.07 -30.07 43.75 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 174.321 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -69.64 -11.46 65.6 Favored Glycine 0 C--N 1.332 0.354 0 CA-C-N 115.286 -0.87 . . . . 0.0 112.65 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -106.83 -36.3 6.7 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 120.705 0.288 . . . . 0.0 110.778 175.547 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 46.4 t -123.85 105.5 9.69 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 120.905 0.383 . . . . 0.0 111.081 -176.184 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.409 ' O ' HD13 ' A' ' 19' ' ' LEU . 30.1 t80 -61.67 -33.64 74.34 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.995 177.391 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -61.15 -40.9 95.57 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.389 175.365 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.54 ' HB2' ' NZ ' ' A' ' 17' ' ' LYS . 4.1 ttmp? -69.75 -33.33 72.3 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.061 -178.457 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 67.6 tp -56.83 -48.52 77.84 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.029 173.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.409 HD13 ' O ' ' A' ' 15' ' ' PHE . 4.9 mp -76.0 -26.47 56.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.011 -179.619 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.0 t -72.92 -35.21 66.99 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.479 -178.613 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 -86.87 125.01 33.71 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.379 -0.601 . . . . 0.0 109.379 -178.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.442 ' O ' ' HB2' ' A' ' 26' ' ' GLU . 17.5 ttp180 -46.27 -47.27 18.2 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 122.87 0.468 . . . . 0.0 111.361 -178.283 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -58.59 -41.45 85.82 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.125 -179.172 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -67.09 -52.19 34.01 Favored Glycine 0 N--CA 1.449 -0.444 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.95 -177.434 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.1 tt -56.49 -40.94 75.81 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.091 0.472 . . . . 0.0 110.173 176.147 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.442 ' HB2' ' O ' ' A' ' 22' ' ' ARG . 1.1 tm-20 -59.04 -55.69 31.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.667 179.804 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.534 ' HA ' ' HD3' ' A' ' 30' ' ' ARG . . . -65.85 -39.29 90.61 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.8 -177.196 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -67.33 -40.94 85.96 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.919 -175.445 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 29.1 p -62.81 -45.01 94.61 Favored 'General case' 0 CA--C 1.529 0.147 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 178.238 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.534 ' HD3' ' HA ' ' A' ' 27' ' ' ALA . 53.0 mtp180 -54.23 -44.36 71.64 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.508 176.286 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.57 ' O ' HG22 ' A' ' 34' ' ' THR . 77.6 t80 -58.94 -48.2 82.34 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.756 178.542 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.412 HD23 HG22 ' A' ' 41' ' ' ILE . 14.2 tp -76.05 -10.9 59.79 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.012 -175.056 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -92.56 -9.87 39.64 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.552 177.847 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.57 HG22 ' O ' ' A' ' 31' ' ' PHE . 2.4 t -76.09 -15.57 60.07 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 121.517 0.675 . . . . 0.0 110.019 178.327 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.427 ' O ' ' N ' ' A' ' 37' ' ' SER . 7.9 pt-20 -145.9 90.58 1.99 Allowed 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 108.358 -0.978 . . . . 0.0 108.358 176.013 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 18.2 p90 -29.65 82.63 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 114.279 1.215 . . . . 0.0 114.279 -171.309 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . 0.427 ' N ' ' O ' ' A' ' 35' ' ' GLU . 16.0 m -134.54 9.21 3.66 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 168.938 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -58.78 -32.13 69.02 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 114.1 -1.409 . . . . 0.0 111.603 -175.522 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.497 ' O ' ' HB2' ' A' ' 43' ' ' PHE . 5.1 mp0 -58.76 -20.21 47.52 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.645 -175.34 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.627 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 44.7 m-80 -75.81 -56.64 4.48 Favored 'General case' 0 C--O 1.241 0.646 0 CA-C-O 121.069 0.462 . . . . 0.0 111.092 -179.02 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.474 ' O ' HG13 ' A' ' 45' ' ' ILE . 10.0 tt -62.14 -43.84 98.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 179.511 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.606 ' HA ' ' HB ' ' A' ' 45' ' ' ILE . 52.1 mt-10 -72.75 -16.53 61.64 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.808 -179.009 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.627 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 66.5 t80 -61.27 -58.32 8.76 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 172.249 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.433 ' O ' ' HB3' ' A' ' 47' ' ' CYS . 37.1 p-90 -78.43 -15.21 58.9 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 119.404 -0.919 . . . . 0.0 111.493 -179.504 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.606 ' HB ' ' HA ' ' A' ' 42' ' ' GLU . 60.4 mt -69.03 -34.3 63.25 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.292 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 168.598 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.67 -31.84 73.13 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.965 -0.562 . . . . 0.0 109.784 173.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.433 ' HB3' ' O ' ' A' ' 44' ' ' TRP . 53.6 t -63.83 -33.6 76.05 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.587 173.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.452 ' HB3' ' O ' ' A' ' 45' ' ' ILE . 15.0 tp10 -66.16 -49.11 68.52 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 174.671 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.431 ' HA ' ' HG2' ' A' ' 52' ' ' LYS . 0.3 OUTLIER -66.66 -15.79 63.74 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.7 176.188 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.505 ' CZ ' HG23 ' A' ' 59' ' ' ILE . 92.7 t80 -78.44 -43.1 28.11 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.879 174.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.417 ' HD3' ' CE1' ' A' ' 99' ' ' HIS . 31.8 ttpt -61.13 -38.83 87.78 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.182 -179.359 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.431 ' HG2' ' HA ' ' A' ' 49' ' ' ASP . 21.9 ptmt -76.05 14.32 0.72 Allowed 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.665 -177.329 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.459 ' HB2' HD13 ' A' ' 59' ' ' ILE . 6.5 m -94.45 88.62 5.55 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 175.116 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.3 pptp? -74.27 -9.62 58.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.297 -177.186 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -91.19 118.52 5.43 Favored Glycine 0 N--CA 1.448 -0.505 0 N-CA-C 111.559 -0.617 . . . . 0.0 111.559 175.562 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.464 ' O ' ' HB ' ' A' ' 59' ' ' ILE . 19.3 Cg_endo -56.65 -30.33 83.24 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.847 2.365 . . . . 0.0 112.019 -176.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . 0.412 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 25.1 mt-30 -71.88 -45.32 61.72 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.916 -0.583 . . . . 0.0 109.858 177.805 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 50.9 tp60 -59.0 -33.13 70.36 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.848 179.256 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.505 HG23 ' CZ ' ' A' ' 50' ' ' PHE . 23.1 mm -55.24 -56.69 10.12 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.732 174.369 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 18.7 m-70 -59.73 -39.78 85.82 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.211 -176.632 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 57' ' ' GLN . 94.6 mt -58.02 -59.61 5.01 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.387 -177.318 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 58.1 mtmt -72.4 -25.39 61.47 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.401 -176.475 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.61 -49.2 74.24 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 120.954 0.407 . . . . 0.0 110.579 176.711 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -63.83 -37.35 87.05 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.546 -179.207 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.9 -52.97 63.46 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.922 179.115 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 68.7 mt -63.53 -35.35 72.24 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.295 179.503 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.519 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 81.3 t80 -54.96 -63.9 1.01 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.7 177.884 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -63.55 -37.53 87.66 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.813 -173.713 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -81.52 -25.09 36.22 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.811 -173.462 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -130.37 -58.8 1.05 Allowed 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 -174.409 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.519 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 51.2 mm -66.81 -29.05 45.06 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -170.202 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -59.31 144.63 45.89 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.599 -177.506 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 16.9 p -61.63 -58.5 7.84 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.956 0.408 . . . . 0.0 109.928 176.824 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -87.59 85.8 7.13 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 172.083 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -117.03 153.09 49.5 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.932 -175.802 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -74.5 9.58 1.82 Allowed 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 122.811 2.341 . . . . 0.0 112.666 178.59 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.622 ' HA ' ' HE3' ' A' ' 77' ' ' LYS . 0.0 OUTLIER -137.61 -52.59 0.65 Allowed 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 122.457 0.303 . . . . 0.0 110.218 177.568 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 64.81 112.7 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.478 0 O-C-N 123.644 0.59 . . . . 0.0 111.301 -179.621 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 39.7 t -104.34 142.07 18.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.022 -0.535 . . . . 0.0 109.871 179.445 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -78.19 19.93 0.42 Allowed 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.992 0.425 . . . . 0.0 111.0 -180.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 28.4 tp -60.29 145.05 48.97 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.223 178.058 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -47.51 128.34 12.35 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.236 176.391 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -61.89 -37.1 83.32 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.93 -176.313 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . 0.432 ' O ' HG23 ' A' ' 88' ' ' VAL . 76.7 t60 -66.57 -35.85 81.23 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.664 0.268 . . . . 0.0 110.454 179.112 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 42.4 m -63.7 -44.43 93.7 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.128 0.489 . . . . 0.0 109.826 174.488 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.465 ' O ' HG23 ' A' ' 90' ' ' THR . 57.9 mtpt -62.38 -35.23 78.53 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.98 176.18 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -62.79 -45.08 94.3 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.793 179.738 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.432 HG23 ' O ' ' A' ' 84' ' ' HIS . 74.9 t -58.44 -43.08 85.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.072 0.463 . . . . 0.0 109.981 177.081 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 70.0 mt -68.65 -41.55 82.79 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.248 -177.896 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.465 HG23 ' O ' ' A' ' 86' ' ' LYS . 43.3 p -62.4 -29.74 70.7 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.837 0.351 . . . . 0.0 111.114 -178.505 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 -85.66 -35.99 20.57 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.032 178.138 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 32.6 t -87.04 -3.46 59.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.438 -0.347 . . . . 0.0 111.485 -176.609 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.1 tp -57.4 -32.3 40.93 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 N-CA-C 111.763 0.283 . . . . 0.0 111.763 -176.436 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 14.6 t -72.98 -31.19 64.37 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 120.739 0.304 . . . . 0.0 110.648 -178.718 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -142.4 79.11 15.9 Favored Pre-proline 0 C--O 1.233 0.19 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 177.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_endo -78.61 157.07 28.35 Favored 'Trans proline' 0 C--O 1.238 0.497 0 C-N-CA 122.614 2.21 . . . . 0.0 112.344 -177.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 41.2 p -85.15 179.69 7.19 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.422 177.224 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.411 ' HG ' ' HG3' ' A' ' 51' ' ' LYS . 41.0 tp -57.3 -34.23 68.49 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.607 -176.21 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' HIS . . . . . 0.533 ' O ' ' N ' ' A' ' 101' ' ' PHE . 41.9 m-70 -107.44 -28.75 9.64 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 119.622 -0.228 . . . . 0.0 111.15 177.09 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 47.1 t 52.06 -76.6 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 123.197 0.599 . . . . 0.0 111.694 178.102 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.533 ' N ' ' O ' ' A' ' 99' ' ' HIS . 34.7 m-85 -70.58 5.46 1.84 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.217 0.607 . . . . 0.0 110.981 179.542 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . 0.503 ' HB2' ' CB ' ' A' ' 99' ' ' HIS . 12.9 t70 -37.49 -54.49 1.13 Allowed 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.343 0.657 . . . . 0.0 112.249 174.595 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.45 -39.78 80.79 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 121.194 0.521 . . . . 0.0 110.771 -179.533 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.82 -30.73 69.34 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.635 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.411 ' HB3' ' O ' ' A' ' 102' ' ' ASP . 21.7 tm0? -58.66 -51.27 70.66 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.623 178.181 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 22.2 m -59.72 -44.62 93.64 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.67 179.645 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . 0.45 ' O ' ' HG ' ' A' ' 111' ' ' LEU . 25.5 mmt180 -55.16 -62.58 1.57 Allowed 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.123 179.41 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 66.2 t -63.02 -37.53 79.6 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.119 -175.641 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 30.1 t80 -55.06 -53.3 57.57 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.966 179.223 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . 0.413 ' HG3' ' O ' ' A' ' 107' ' ' ARG . 5.2 pp0? -71.6 -28.99 64.19 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 121.177 -0.209 . . . . 0.0 110.998 -176.896 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' ' 107' ' ' ARG . 84.5 mt -60.17 -47.62 85.15 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 120.974 0.416 . . . . 0.0 110.219 175.632 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . 0.449 ' SD ' ' HB ' ' A' ' 41' ' ' ILE . 36.9 mtm -69.56 -37.82 77.18 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.281 178.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . 0.65 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 40.2 tt0 -58.73 -61.92 2.25 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.695 -177.434 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -53.95 -28.54 37.99 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 -172.28 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -117.91 -61.92 1.62 Allowed 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 -176.19 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 9.2 m -64.7 -34.49 78.42 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.29 -0.414 . . . . 0.0 112.066 -173.583 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . 0.65 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 17.9 t80 -64.68 -54.45 31.41 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 120.442 0.163 . . . . 0.0 111.308 -175.503 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 14.2 t -61.65 -34.67 76.11 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.021 0.439 . . . . 0.0 110.435 -179.68 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 32.2 ttt180 -69.12 -37.41 78.33 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.864 179.103 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 82.8 t80 -60.0 -41.02 91.18 Favored 'General case' 0 C--N 1.334 -0.094 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.805 175.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 86.9 mt -61.84 -31.54 71.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.561 177.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 15.4 tptm -95.55 -2.65 48.05 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.689 -177.206 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 56.4 p -72.56 159.52 33.76 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 120.741 0.305 . . . . 0.0 110.888 -178.709 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -55.12 -34.4 63.68 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.106 175.061 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 68.6 mt -59.41 -53.68 44.82 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.231 -178.23 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 70.0 t80 -68.24 -38.96 82.38 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.656 0.265 . . . . 0.0 110.345 -177.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 93.0 mt -61.99 -32.59 73.07 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 120.882 0.372 . . . . 0.0 110.439 177.892 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -68.39 -35.98 78.48 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.971 176.055 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.46 HD22 HG11 ' A' ' 3' ' ' VAL . 94.0 mt -78.04 -11.93 59.95 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.013 178.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' MET . . . . . . . . . . . . . 4.2 mmt . . . . . 0 C--N 1.331 -0.21 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.867 178.748 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.461 HG21 ' CH2' ' A' ' 11' ' ' TRP . 3.1 p . . . . . 0 C--O 1.233 0.195 0 CA-C-O 120.758 0.313 . . . . 0.0 110.362 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.0 p -103.36 148.77 36.21 Favored Pre-proline 0 C--N 1.327 -0.383 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 175.096 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_exo -51.78 -24.89 19.36 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 122.836 2.357 . . . . 0.0 112.617 178.355 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.05 -40.92 95.45 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.406 0.622 . . . . 0.0 109.5 176.102 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.41 ' HB3' HG23 ' A' ' 3' ' ' VAL . 9.3 tp10 -74.0 -30.25 62.37 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.803 176.616 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.17 -52.68 61.42 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.727 178.784 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 27.0 m -65.1 -27.01 41.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.487 177.035 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.557 ' O ' ' HD2' ' A' ' 17' ' ' LYS . 5.0 tppt? -61.71 -46.5 89.41 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 175.84 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.461 ' CH2' HG21 ' A' ' 3' ' ' VAL . 47.9 m0 -59.64 -28.81 67.56 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.44 177.507 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -60.3 -17.23 45.72 Favored Glycine 0 C--N 1.334 0.452 0 CA-C-N 115.602 -0.726 . . . . 0.0 112.465 177.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -76.22 -48.51 20.09 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 120.727 0.299 . . . . 0.0 110.952 177.622 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 38.8 m -146.35 121.71 10.29 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-O 121.064 0.459 . . . . 0.0 112.161 -172.23 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.414 ' O ' HD13 ' A' ' 19' ' ' LEU . 22.4 t80 -52.05 -28.38 17.11 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.093 174.303 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -54.27 -58.52 7.09 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.454 175.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.557 ' HD2' ' O ' ' A' ' 10' ' ' LYS . 0.4 OUTLIER -72.15 -16.77 61.98 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.849 -174.058 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 63.0 tp -65.85 -42.91 89.86 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 121.107 0.479 . . . . 0.0 109.764 171.316 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.414 HD13 ' O ' ' A' ' 15' ' ' PHE . 2.7 mp -78.63 -42.43 28.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.529 -176.713 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.553 ' OG ' ' HA ' ' A' ' 17' ' ' LYS . 12.7 p -65.91 -22.94 66.54 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 120.88 0.371 . . . . 0.0 111.091 -178.379 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -82.66 108.92 16.4 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 174.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.5 ptm180 -40.81 -37.33 0.75 Allowed 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.011 0.524 . . . . 0.0 111.806 177.434 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -77.34 -35.31 54.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.133 -178.678 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -68.59 -51.88 28.56 Favored Glycine 0 C--N 1.331 0.259 0 N-CA-C 111.417 -0.673 . . . . 0.0 111.417 179.519 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.7 tt -55.55 -37.4 67.93 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.846 -0.428 . . . . 0.0 109.846 174.233 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.564 ' O ' ' HG3' ' A' ' 30' ' ' ARG . 43.0 tt0 -62.34 -47.82 82.55 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.674 178.709 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -66.57 -40.52 89.01 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.108 0.48 . . . . 0.0 110.327 179.123 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -65.34 -41.53 93.83 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.958 -177.013 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.476 HG22 ' O ' ' A' ' 26' ' ' GLU . 10.4 t -66.36 -36.11 82.05 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 120.559 0.219 . . . . 0.0 110.693 -179.0 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.564 ' HG3' ' O ' ' A' ' 26' ' ' GLU . 49.3 mtt180 -59.27 -43.57 92.48 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 121.17 0.51 . . . . 0.0 110.067 177.166 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.582 ' O ' HG22 ' A' ' 34' ' ' THR . 87.9 t80 -72.81 -46.67 51.91 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.778 -179.819 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 20.8 tp -60.28 -26.37 66.43 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.575 -173.278 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.411 ' NZ ' ' OG1' ' A' ' 29' ' ' THR . 46.5 mttp -66.12 -18.57 65.43 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 112.276 0.473 . . . . 0.0 112.276 -179.522 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.582 HG22 ' O ' ' A' ' 31' ' ' PHE . 5.9 t -77.09 -21.06 54.91 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 120.68 0.276 . . . . 0.0 110.84 -179.171 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -111.66 -7.07 14.28 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.965 -178.654 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 62.02 17.29 8.91 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.87 -0.605 . . . . 0.0 112.036 175.681 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 32.0 t -78.47 6.54 8.31 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.479 0.656 . . . . 0.0 110.128 178.246 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -64.2 -19.16 65.15 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.605 -176.378 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -58.61 -29.08 66.2 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 121.104 0.478 . . . . 0.0 110.178 177.681 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.602 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 90.5 m-20 -73.82 -50.39 20.66 Favored 'General case' 0 C--O 1.242 0.678 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.029 -179.215 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.473 HG13 ' CZ2' ' A' ' 44' ' ' TRP . 13.3 tt -63.96 -42.36 95.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 -179.816 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.54 ' HA ' ' HB ' ' A' ' 45' ' ' ILE . 48.8 mt-10 -65.92 -26.48 67.62 Favored 'General case' 0 N--CA 1.461 0.124 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.77 177.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.602 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 37.9 t80 -56.6 -61.35 2.48 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 116.583 -0.28 . . . . 0.0 110.291 175.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.473 ' CZ2' HG13 ' A' ' 41' ' ' ILE . 39.9 p-90 -78.68 -18.29 54.61 Favored 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 119.432 -0.907 . . . . 0.0 111.555 -178.072 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.54 ' HB ' ' HA ' ' A' ' 42' ' ' GLU . 24.0 mt -64.13 -37.37 79.7 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.287 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 169.771 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.04 -35.61 81.28 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.7 174.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.83 ' SG ' ' HB2' ' A' ' 101' ' ' PHE . 41.6 t -64.89 -36.09 83.23 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.819 175.131 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.598 ' HA ' ' HB3' ' A' ' 51' ' ' LYS . 15.7 mt-10 -77.95 -25.02 47.98 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 121.009 -0.276 . . . . 0.0 110.56 177.851 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -64.34 -38.56 91.48 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.851 0.834 . . . . 0.0 108.816 171.005 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -64.73 -37.74 88.62 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.405 -1.271 . . . . 0.0 110.102 172.462 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.598 ' HB3' ' HA ' ' A' ' 48' ' ' GLU . 4.7 tmtm? -70.59 -23.1 62.51 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.473 178.65 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.481 ' HG3' ' O ' ' A' ' 48' ' ' GLU . 57.6 mtpt -57.83 -37.11 73.25 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.164 0.507 . . . . 0.0 110.779 177.25 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.414 ' CB ' ' HG2' ' A' ' 58' ' ' GLN . 10.2 p -91.11 154.26 19.49 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.076 -177.055 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.01 9.66 4.9 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.977 -179.13 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . 0.436 ' O ' HG12 ' A' ' 59' ' ' ILE . . . -83.28 121.23 5.41 Favored Glycine 0 C--N 1.332 0.356 0 N-CA-C 111.465 -0.654 . . . . 0.0 111.465 176.167 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_endo -55.34 -31.7 78.19 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 122.871 2.381 . . . . 0.0 112.768 -174.284 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . 0.51 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 24.6 mp0 -67.12 -51.33 55.36 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 176.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.414 ' HG2' ' CB ' ' A' ' 53' ' ' SER . 7.9 tp60 -55.27 -38.92 69.2 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.414 179.008 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.436 HG12 ' O ' ' A' ' 55' ' ' GLY . 39.9 mm -52.3 -57.82 3.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.056 179.757 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.4 ' CE1' ' HD2' ' A' ' 96' ' ' PRO . 70.5 m-70 -64.37 -37.52 87.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.556 -0.293 . . . . 0.0 111.094 -176.798 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 57' ' ' GLN . 89.0 mt -58.26 -60.9 3.04 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-O 120.865 0.364 . . . . 0.0 110.962 -179.141 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -65.37 -45.24 84.88 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.234 -177.395 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.8 -49.26 77.21 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.82 0.343 . . . . 0.0 111.333 -178.104 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -66.26 -30.77 71.28 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.488 -177.391 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -69.73 -53.98 15.88 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.527 178.375 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 74.3 mt -58.21 -35.49 53.42 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 CA-C-O 121.324 0.583 . . . . 0.0 110.078 177.799 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 85.5 t80 -56.04 -58.27 8.6 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.622 177.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -71.63 -25.42 62.15 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.092 -0.504 . . . . 0.0 112.218 -175.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 65.7 tttp -86.78 -29.02 22.63 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 111.566 0.21 . . . . 0.0 111.566 -176.705 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -127.76 -53.94 1.33 Allowed 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -174.754 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 45.2 mm -71.51 -19.77 20.69 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 CA-C-O 120.77 0.319 . . . . 0.0 111.575 -171.238 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.501 ' HB3' ' HB2' ' A' ' 75' ' ' ALA . 53.9 tp60 -51.74 135.89 28.5 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.811 178.544 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 19.3 p -50.8 -49.79 57.65 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.942 -176.119 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -85.89 -62.89 1.42 Allowed 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 174.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.501 ' HB2' ' HB3' ' A' ' 72' ' ' GLN . . . 60.09 158.57 0.11 Allowed Pre-proline 0 N--CA 1.469 0.485 0 C-N-CA 122.996 0.518 . . . . 0.0 112.253 176.316 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -70.18 -23.76 28.53 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.218 1.945 . . . . 0.0 111.26 173.097 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -95.81 -41.11 9.0 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.079 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 55.81 88.52 0.04 OUTLIER 'General case' 0 C--O 1.234 0.266 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 -172.142 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.477 HG12 ' H ' ' A' ' 81' ' ' LEU . 24.3 t -90.91 126.34 43.64 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.683 -172.499 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 37.1 m-80 -74.73 15.89 0.33 Allowed 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.591 -177.442 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.477 ' H ' HG12 ' A' ' 79' ' ' VAL . 16.8 tp -57.17 146.97 26.23 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.212 -0.449 . . . . 0.0 109.883 174.734 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -46.89 131.07 12.12 Favored 'General case' 0 C--O 1.237 0.414 0 O-C-N 123.606 0.566 . . . . 0.0 112.39 -176.524 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 36.6 p90 -55.94 -44.98 78.89 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.155 -0.93 . . . . 0.0 111.744 -177.39 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . 0.455 ' O ' HG23 ' A' ' 88' ' ' VAL . 81.1 t60 -67.92 -32.83 73.56 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.83 0.348 . . . . 0.0 110.32 -176.661 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 49.7 m -65.86 -47.19 75.75 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.025 176.696 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.421 ' HE2' ' O ' ' A' ' 81' ' ' LEU . 58.0 mtmt -65.06 -30.72 71.7 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.151 176.959 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -63.52 -50.0 71.31 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.827 179.035 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.455 HG23 ' O ' ' A' ' 84' ' ' HIS . 91.8 t -56.77 -44.91 82.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 121.003 0.43 . . . . 0.0 110.173 178.489 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 70.5 mt -63.22 -47.43 92.3 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.073 -178.768 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 20.2 p -61.64 -26.07 67.77 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 120.763 0.316 . . . . 0.0 111.681 -176.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 42.0 m-80 -94.85 -14.69 24.35 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 111.663 0.245 . . . . 0.0 111.663 178.907 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 33.0 m -108.45 -4.77 17.03 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 111.664 0.246 . . . . 0.0 111.664 -177.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.448 ' O ' ' HD3' ' A' ' 96' ' ' PRO . 9.6 tp -61.35 -18.72 18.99 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 CA-C-O 120.878 0.371 . . . . 0.0 111.363 -177.757 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.524 HG23 ' HG2' ' A' ' 95' ' ' GLN . 8.9 t -60.72 -29.55 69.43 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.595 177.667 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.524 ' HG2' HG23 ' A' ' 94' ' ' THR . 3.4 pt20 -149.2 77.44 9.05 Favored Pre-proline 0 CA--C 1.532 0.288 0 CA-C-O 121.351 0.596 . . . . 0.0 110.172 178.123 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . 0.448 ' HD3' ' O ' ' A' ' 93' ' ' ILE . 72.3 Cg_endo -73.78 129.76 13.86 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.602 2.201 . . . . 0.0 112.125 -178.033 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 68.7 p -85.04 175.3 9.11 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.29 177.615 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 31.1 tp -60.56 -19.12 56.5 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 121.434 0.635 . . . . 0.0 110.675 -179.118 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' HIS . . . . . 0.79 ' HB3' ' HB2' ' A' ' 102' ' ' ASP . 28.5 m-70 -128.49 39.16 3.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.987 178.226 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 22.4 t -59.41 -30.99 68.86 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.121 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.83 ' HB2' ' SG ' ' A' ' 47' ' ' CYS . 59.0 m-85 -104.38 19.74 19.72 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.578 -178.704 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . 0.79 ' HB2' ' HB3' ' A' ' 99' ' ' HIS . 24.2 t70 -58.88 -43.07 90.84 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.265 -175.786 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.463 ' O ' ' HG2' ' A' ' 107' ' ' ARG . . . -68.66 -41.29 79.51 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.105 179.232 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -58.42 -39.9 81.05 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.166 178.035 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.463 ' HG2' ' HB2' ' A' ' 44' ' ' TRP . 23.0 tm0? -57.54 -51.27 70.15 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.769 177.833 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 36.3 t -63.61 -37.08 85.98 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.159 -178.102 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . 0.529 ' O ' ' HG ' ' A' ' 111' ' ' LEU . 12.3 mmm180 -67.25 -46.88 72.41 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.504 0.192 . . . . 0.0 111.095 -178.553 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 61.4 t -68.85 -34.99 67.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 121.348 0.594 . . . . 0.0 109.927 177.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -55.49 -51.75 65.94 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.548 175.087 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . 0.478 ' O ' ' HG2' ' A' ' 114' ' ' GLN . 3.9 pt20 -69.68 -29.67 67.16 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.068 -177.819 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 107' ' ' ARG . 80.9 mt -63.02 -43.55 98.42 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 120.907 0.384 . . . . 0.0 110.465 177.295 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 43.5 mtm -74.27 -28.52 61.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.024 0.44 . . . . 0.0 110.06 177.605 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . 0.609 ' HA ' ' HB3' ' A' ' 117' ' ' TYR . 8.2 tm-20 -60.28 -65.48 0.68 Allowed 'General case' 0 C--O 1.236 0.373 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.333 179.211 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . 0.478 ' HG2' ' O ' ' A' ' 110' ' ' GLN . 14.6 pt20 -56.22 -28.7 59.33 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 -174.468 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -105.91 -62.38 1.38 Allowed 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -176.473 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 12.9 m -75.93 -37.95 58.17 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 111.933 0.345 . . . . 0.0 111.933 -173.346 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . 0.609 ' HB3' ' HA ' ' A' ' 113' ' ' GLU . 25.6 t80 -72.83 -40.43 65.77 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.775 -0.193 . . . . 0.0 111.136 -174.328 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 24.6 p -57.57 -53.22 60.68 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-O 121.368 0.604 . . . . 0.0 109.851 175.653 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . 0.436 HH11 ' HD3' ' A' ' 119' ' ' ARG . 28.9 mtp-105 -58.75 -38.47 78.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.007 177.119 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -61.6 -39.18 90.31 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.735 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.488 HD11 ' CZ ' ' A' ' 117' ' ' TYR . 82.4 mt -70.09 -27.24 64.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.816 0.341 . . . . 0.0 110.88 179.167 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . 0.76 ' HA ' ' HE3' ' A' ' 122' ' ' LYS . 0.2 OUTLIER -100.41 1.49 41.37 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.112 -178.979 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 83.5 p -64.68 148.14 51.62 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 120.778 0.323 . . . . 0.0 110.838 -177.587 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -63.06 -35.28 79.71 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.523 -178.602 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 6.4 tp -64.12 -40.37 88.8 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.864 178.002 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 83.2 t80 -60.34 -43.09 96.77 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.145 0.498 . . . . 0.0 109.893 178.28 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 69.4 mt -66.12 -31.52 72.42 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.436 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -64.84 -38.77 92.09 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.997 176.676 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 86.6 mt -61.7 -40.71 95.98 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.927 175.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' MET . . . . . . . . . . . . . 86.9 mmm . . . . . 0 C--O 1.234 0.24 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.412 179.45 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.5 p . . . . . 0 CA--C 1.531 0.226 0 CA-C-O 120.699 0.285 . . . . 0.0 111.239 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.0 m -86.72 148.25 45.62 Favored Pre-proline 0 CA--C 1.534 0.33 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 175.286 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -53.63 -30.63 56.27 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.743 2.295 . . . . 0.0 113.04 -173.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 28.5 tp10 -60.52 -43.15 97.45 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 121.173 0.511 . . . . 0.0 110.303 177.155 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -76.55 -32.5 58.24 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.944 179.478 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.14 -49.91 70.28 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.848 179.19 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 33.7 m -66.9 -28.34 42.69 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 177.539 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.568 ' O ' ' HD2' ' A' ' 17' ' ' LYS . 8.4 tppt? -57.85 -48.85 78.59 Favored 'General case' 0 CA--C 1.527 0.094 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.388 176.523 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.437 ' HB3' HD13 ' A' ' 18' ' ' LEU . 49.1 m0 -59.54 -33.11 70.97 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.505 178.224 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -69.11 -8.18 58.07 Favored Glycine 0 C--N 1.331 0.281 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.903 -178.607 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -79.37 -34.14 42.29 Favored 'General case' 0 C--N 1.33 -0.248 0 O-C-N 122.839 -0.212 . . . . 0.0 110.618 177.647 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.477 ' HB3' ' HG2' ' A' ' 17' ' ' LYS . 35.5 t -161.0 129.26 4.43 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 120.996 0.427 . . . . 0.0 111.56 -176.01 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.45 ' O ' HD13 ' A' ' 19' ' ' LEU . 10.1 t80 -58.23 -27.61 64.1 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.597 175.775 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -60.78 -48.71 80.56 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.048 177.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.568 ' HD2' ' O ' ' A' ' 10' ' ' LYS . 19.3 ptpt -80.19 -11.74 59.71 Favored 'General case' 0 C--O 1.233 0.192 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.796 -177.007 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.437 HD13 ' HB3' ' A' ' 11' ' ' TRP . 60.0 tp -69.0 -45.93 69.32 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 170.411 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.45 HD13 ' O ' ' A' ' 15' ' ' PHE . 8.0 mp -61.83 -30.31 70.75 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.839 176.268 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.4 t -58.12 -21.13 45.19 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.168 178.439 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . 0.474 ' HB3' ' H ' ' A' ' 24' ' ' GLY . 0.8 OUTLIER -102.41 136.5 42.12 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 176.634 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.03 -47.56 50.89 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 121.137 0.494 . . . . 0.0 110.098 177.329 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 30.2 p-10 -69.78 -33.9 73.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.277 178.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.474 ' H ' ' HB3' ' A' ' 21' ' ' HIS . . . -64.14 -45.5 93.57 Favored Glycine 0 C--N 1.333 0.377 0 N-CA-C 111.388 -0.685 . . . . 0.0 111.388 173.363 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.5 tp -53.38 -52.4 59.41 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.365 0.603 . . . . 0.0 110.158 174.067 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.644 ' O ' ' HG2' ' A' ' 30' ' ' ARG . 27.9 tt0 -60.33 -42.4 95.56 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.514 -177.663 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.4 ' O ' ' HB2' ' A' ' 30' ' ' ARG . . . -55.21 -47.3 75.51 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-O 121.28 0.562 . . . . 0.0 110.134 177.669 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 90.6 t80 -59.92 -49.09 79.04 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.633 178.236 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.563 HG22 ' HA ' ' A' ' 26' ' ' GLU . 6.0 t -65.88 -24.57 66.88 Favored 'General case' 0 C--O 1.225 -0.211 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.571 -177.243 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.644 ' HG2' ' O ' ' A' ' 26' ' ' GLU . 31.5 mmt180 -57.56 -48.96 77.91 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 173.391 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.601 ' O ' HG22 ' A' ' 34' ' ' THR . 86.5 t80 -69.73 -33.83 73.02 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.655 178.434 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.46 HD23 ' HB ' ' A' ' 41' ' ' ILE . 27.5 tp -72.71 -26.19 61.5 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 121.005 0.431 . . . . 0.0 110.916 -178.241 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.491 ' HG3' ' O ' ' A' ' 29' ' ' THR . 28.2 mtpp -75.4 -38.29 59.97 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.091 179.652 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.601 HG22 ' O ' ' A' ' 31' ' ' PHE . 12.0 t -68.18 -15.96 63.79 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 120.804 0.335 . . . . 0.0 110.825 -176.689 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -109.55 23.78 13.97 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.265 175.437 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 50.4 p90 45.12 26.24 0.22 Allowed 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.603 1.161 . . . . 0.0 113.587 174.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 10.4 t -108.04 20.13 19.11 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.043 0.449 . . . . 0.0 110.193 -179.219 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.631 ' O ' HG22 ' A' ' 41' ' ' ILE . 10.2 pt-20 -63.34 -22.44 66.88 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.564 -176.603 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -53.02 -26.37 15.3 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.662 0.268 . . . . 0.0 111.263 -179.584 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.433 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 8.4 m120 -67.12 -49.7 63.99 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-O 121.047 0.451 . . . . 0.0 110.447 177.761 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.631 HG22 ' O ' ' A' ' 38' ' ' GLU . 6.3 tp -63.85 -42.75 96.87 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.122 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.197 -176.555 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -71.63 -25.84 62.32 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.26 -178.193 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.445 ' HE1' ' HB3' ' A' ' 70' ' ' PHE . 41.3 t80 -60.57 -67.86 0.36 Allowed 'General case' 0 C--O 1.237 0.412 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.969 179.483 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.512 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 35.6 p-90 -75.96 -23.57 55.36 Favored 'General case' 0 C--O 1.225 -0.187 0 C-N-CA 119.402 -0.919 . . . . 0.0 111.954 -174.821 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 26.4 mt -57.9 -38.67 67.58 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 C-N-CA 120.405 -0.518 . . . . 0.0 109.769 172.237 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.407 ' O ' ' HB2' ' A' ' 49' ' ' ASP . . . -66.03 -37.24 85.39 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 121.137 0.494 . . . . 0.0 110.034 175.19 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.575 ' O ' ' HB3' ' A' ' 50' ' ' PHE . 71.6 m -72.15 -17.17 61.98 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.297 177.685 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.512 ' HG2' ' O ' ' A' ' 44' ' ' TRP . 12.3 mm-40 -73.98 -37.36 64.48 Favored 'General case' 0 C--O 1.225 -0.22 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 171.286 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.461 ' O ' ' HB2' ' A' ' 52' ' ' LYS . 5.8 m-20 -59.12 -29.77 67.64 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 172.149 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.575 ' HB3' ' O ' ' A' ' 47' ' ' CYS . 85.2 t80 -64.43 -40.61 96.08 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.971 173.875 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.566 ' HE3' ' CE1' ' A' ' 99' ' ' HIS . 60.0 mttp -58.87 -31.78 68.87 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.091 0.472 . . . . 0.0 110.236 173.552 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.56 ' N ' ' HE2' ' A' ' 52' ' ' LYS . 1.1 mpmm? -70.1 -24.73 63.25 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.419 -179.851 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.475 ' HB3' ' HG3' ' A' ' 58' ' ' GLN . 39.1 m -60.73 127.42 31.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.714 0.768 . . . . 0.0 110.963 -177.289 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 28.5 tptp -110.58 128.7 55.77 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 114.647 -1.161 . . . . 0.0 110.152 -176.072 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 100.68 131.64 7.46 Favored Glycine 0 CA--C 1.519 0.282 0 N-CA-C 111.701 -0.56 . . . . 0.0 111.701 -178.292 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.476 ' O ' ' HD2' ' A' ' 60' ' ' HIS . 12.1 Cg_endo -54.54 -46.52 32.84 Favored 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 122.794 2.329 . . . . 0.0 111.847 -178.492 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -53.7 -48.0 69.96 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.058 0.456 . . . . 0.0 110.282 178.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.475 ' HG3' ' HB3' ' A' ' 53' ' ' SER . 8.4 tp-100 -55.57 -42.77 75.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.121 177.033 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.537 HG22 ' HG2' ' A' ' 96' ' ' PRO . 47.5 mm -60.85 -39.9 83.44 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.024 179.334 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.476 ' HD2' ' O ' ' A' ' 56' ' ' PRO . 74.2 m-70 -61.93 -55.02 33.84 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 120.673 0.273 . . . . 0.0 110.854 -179.207 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.539 HD12 ' N ' ' A' ' 62' ' ' LYS . 4.2 pp -67.69 -35.66 79.23 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.357 -176.217 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.539 ' N ' HD12 ' A' ' 61' ' ' LEU . 32.0 mmtp -65.67 -38.8 90.31 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 120.946 0.403 . . . . 0.0 110.005 176.363 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.83 -49.03 79.13 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.751 179.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 53.7 mmtt -54.26 -43.07 70.64 Favored 'General case' 0 N--CA 1.466 0.351 0 O-C-N 123.273 0.358 . . . . 0.0 111.191 178.256 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.02 -61.07 2.55 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.064 -179.895 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 63.9 mt -64.08 -37.6 80.27 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-O 121.334 0.588 . . . . 0.0 110.586 -178.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -57.24 -57.39 12.84 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.179 -177.135 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -78.15 -23.04 47.9 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.919 -172.796 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -99.76 -16.82 17.98 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -174.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . 0.445 ' HB3' ' HE1' ' A' ' 43' ' ' PHE . 97.3 m-85 -132.56 -49.17 0.9 Allowed 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 -176.405 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 50.6 mm -74.89 -32.51 27.88 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -169.725 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 51.2 mm-40 -64.67 143.44 57.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.98 0.419 . . . . 0.0 111.556 179.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 22.1 m -62.46 -28.94 70.17 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.212 177.223 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -98.47 24.43 7.38 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.501 -178.211 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -89.57 152.31 47.03 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.58 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_exo -67.34 15.81 0.13 Allowed 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 123.248 2.632 . . . . 0.0 113.732 -177.165 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -130.4 -27.21 2.21 Favored 'General case' 0 C--N 1.331 -0.238 0 O-C-N 122.333 -0.229 . . . . 0.0 111.236 177.852 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 48.73 42.21 19.27 Favored 'General case' 0 N--CA 1.466 0.353 0 O-C-N 123.498 0.499 . . . . 0.0 110.937 177.055 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 58.3 t -47.47 133.34 4.42 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 CA-C-N 115.264 -0.88 . . . . 0.0 111.848 -174.653 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.475 HD22 ' N ' ' A' ' 80' ' ' ASN . 0.9 OUTLIER -70.84 76.46 0.62 Allowed 'General case' 0 C--O 1.237 0.413 0 CA-C-O 121.283 0.563 . . . . 0.0 110.911 -178.558 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.569 HD23 ' HB3' ' A' ' 86' ' ' LYS . 55.2 tp -113.79 144.68 42.59 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.32 -0.854 . . . . 0.0 109.918 177.075 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -67.2 145.73 54.92 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 120.815 0.341 . . . . 0.0 110.91 178.644 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 91.7 t80 -58.32 -50.85 72.16 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.465 -176.602 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . 0.438 ' O ' ' HB3' ' A' ' 87' ' ' GLU . 85.7 t60 -61.14 -33.26 73.12 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.615 0.245 . . . . 0.0 111.176 -175.61 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 25.7 m -69.03 -50.13 51.43 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.805 0.336 . . . . 0.0 110.79 178.671 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.569 ' HB3' HD23 ' A' ' 81' ' ' LEU . 12.2 ptmm? -70.69 -19.96 62.73 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.084 0.468 . . . . 0.0 110.295 178.645 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.438 ' HB3' ' O ' ' A' ' 84' ' ' HIS . 37.1 tt0 -61.84 -54.77 37.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.613 173.6 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 84' ' ' HIS . 59.2 t -55.01 -41.24 57.65 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.215 178.077 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 73.2 mt -60.15 -53.21 51.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.118 179.722 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.522 HG23 ' O ' ' A' ' 86' ' ' LYS . 66.7 p -58.48 -30.57 67.1 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 120.799 0.333 . . . . 0.0 111.596 -176.173 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 41.8 m-80 -83.53 -29.56 27.79 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.492 -179.521 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 16.1 m -101.14 -0.99 35.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.711 0.291 . . . . 0.0 111.4 -175.55 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.5 tp -61.97 -21.2 25.61 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-O 120.851 0.358 . . . . 0.0 111.357 -176.65 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 9.5 t -62.64 -37.83 87.89 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.623 179.255 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -138.83 77.15 33.14 Favored Pre-proline 0 C--O 1.234 0.272 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.259 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . 0.537 ' HG2' HG22 ' A' ' 59' ' ' ILE . 72.8 Cg_endo -76.92 151.76 31.43 Favored 'Trans proline' 0 C--O 1.235 0.374 0 C-N-CA 122.649 2.232 . . . . 0.0 112.102 -178.173 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . 0.455 HG22 ' H ' ' A' ' 98' ' ' LEU . 5.8 m -96.43 168.71 10.39 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 116.035 -0.529 . . . . 0.0 109.823 178.353 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.455 ' H ' HG22 ' A' ' 97' ' ' THR . 61.1 tp -45.79 -36.61 5.29 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 -175.275 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' HIS . . . . . 0.791 ' HB3' ' HB2' ' A' ' 102' ' ' ASP . 55.1 m-70 -98.13 -52.5 3.67 Favored 'General case' 0 N--CA 1.464 0.242 0 O-C-N 122.25 -0.281 . . . . 0.0 110.852 -179.255 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 33.2 t 51.5 -81.94 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.105 0.562 . . . . 0.0 112.507 174.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . 0.444 ' N ' ' O ' ' A' ' 99' ' ' HIS . 50.4 m-85 -74.55 -1.55 21.91 Favored 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 122.635 0.374 . . . . 0.0 111.287 -174.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . 0.791 ' HB2' ' HB3' ' A' ' 99' ' ' HIS . 8.0 t70 -51.52 -43.53 62.3 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.44 -176.205 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.33 -41.29 88.8 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 121.256 0.551 . . . . 0.0 110.373 177.269 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.09 -36.35 83.73 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.348 178.181 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.443 ' OE1' ' SG ' ' A' ' 47' ' ' CYS . 15.9 mm-40 -66.38 -36.84 83.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.449 179.583 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 52.0 m -62.06 -35.4 78.51 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.573 177.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . 0.514 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 0.0 OUTLIER -60.69 -49.47 77.4 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-O 121.025 0.441 . . . . 0.0 110.06 178.228 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.485 HG12 ' SD ' ' A' ' 112' ' ' MET . 96.7 t -64.28 -46.0 94.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.285 178.022 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -52.5 -47.06 66.82 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.601 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . 0.514 ' HG3' ' O ' ' A' ' 107' ' ' ARG . 0.0 OUTLIER -70.64 -31.06 67.85 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 121.139 -0.224 . . . . 0.0 110.773 -176.077 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.534 ' HA ' HE21 ' A' ' 114' ' ' GLN . 95.2 mt -62.58 -49.0 77.0 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.482 0.658 . . . . 0.0 109.339 172.831 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . 0.485 ' SD ' HG12 ' A' ' 108' ' ' VAL . 66.0 mtp -60.42 -38.17 83.21 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.296 178.811 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . 0.613 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 39.7 tt0 -61.23 -65.72 0.65 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.718 -178.825 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . 0.534 HE21 ' HA ' ' A' ' 111' ' ' LEU . 27.2 pt20 -60.93 -32.34 71.84 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.861 -174.426 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -90.4 -70.29 0.68 Allowed 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 -177.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 4.7 p -86.28 -25.01 25.72 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 -169.115 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . 0.613 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 38.2 t80 -71.55 -41.08 69.55 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 118.398 0.545 . . . . 0.0 110.659 -178.407 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 31.6 p -60.35 -51.99 67.17 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 121.321 0.581 . . . . 0.0 110.141 176.799 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 43.2 mtm-85 -59.03 -36.04 74.31 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.445 177.434 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 65.7 t80 -62.78 -38.09 89.25 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.616 177.442 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 82.5 mt -65.35 -27.22 68.43 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.788 0.327 . . . . 0.0 110.641 178.583 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . 0.783 ' HA ' ' HE2' ' A' ' 122' ' ' LYS . 10.4 mmpt? -102.6 1.83 35.28 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.784 178.729 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . 0.457 ' OG ' HG22 ' A' ' 125' ' ' ILE . 79.0 p -72.96 143.16 47.74 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.749 0.309 . . . . 0.0 110.707 -179.352 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -59.99 -25.98 65.69 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.213 178.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.474 HD13 ' O ' ' A' ' 125' ' ' ILE . 0.0 OUTLIER -67.27 -36.64 77.27 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 177.854 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 84.0 t80 -64.61 -38.45 91.06 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 121.068 0.461 . . . . 0.0 109.913 174.696 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.528 HD13 ' HG3' ' A' ' 130' ' ' MET . 4.4 mm? -65.17 -22.59 66.93 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.751 177.027 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . 0.41 ' HB3' ' O ' ' A' ' 125' ' ' ILE . 24.8 t70 -73.9 -33.44 64.0 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 121.193 0.521 . . . . 0.0 109.683 173.96 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 66.9 mt -72.76 -23.38 60.81 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.796 178.09 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' MET . . . . . 0.528 ' HG3' HD13 ' A' ' 127' ' ' LEU . 2.4 mmt . . . . . 0 CA--C 1.529 0.163 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.954 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.2 p . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.776 0.322 . . . . 0.0 110.885 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 49.8 m -80.02 141.87 55.11 Favored Pre-proline 0 C--O 1.236 0.349 0 CA-C-N 116.148 -0.478 . . . . 0.0 109.996 176.136 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -51.39 -35.01 52.91 Favored 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 122.804 2.336 . . . . 0.0 112.898 -177.14 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.526 ' O ' ' HG2' ' A' ' 10' ' ' LYS . 14.5 mm-40 -69.0 -34.68 75.67 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.991 -179.359 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 23.4 mm-40 -71.44 -32.79 68.75 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 172.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.35 -42.81 98.95 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.706 178.944 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.483 HG22 ' O ' ' A' ' 6' ' ' GLU . 17.4 m -69.71 -28.31 36.79 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-O 120.98 0.419 . . . . 0.0 110.087 176.914 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.541 ' HA ' ' HG2' ' A' ' 13' ' ' GLU . 71.6 mmtt -66.56 -31.06 71.53 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.368 174.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.437 ' CD1' ' HG2' ' A' ' 17' ' ' LYS . 48.2 m0 -62.24 -25.75 68.0 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 173.183 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -79.85 -22.99 62.76 Favored Glycine 0 C--N 1.333 0.405 0 CA-C-N 115.565 -0.743 . . . . 0.0 112.927 -178.551 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.541 ' HG2' ' HA ' ' A' ' 10' ' ' LYS . 8.2 pt-20 -101.88 -18.07 15.89 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.821 0.31 . . . . 0.0 110.871 178.278 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 42.1 m -134.8 96.97 3.65 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.893 0.377 . . . . 0.0 111.519 -177.779 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -58.28 -34.13 70.18 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 175.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -54.55 -48.94 71.41 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.802 174.367 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.451 ' HD2' ' HB3' ' A' ' 10' ' ' LYS . 22.0 ttmm -67.22 -35.24 79.17 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.8 -177.494 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 67.1 tp -57.63 -49.58 75.96 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.066 -0.516 . . . . 0.0 109.924 176.453 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.5 mp -73.45 -30.26 63.08 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.966 179.748 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 26.0 t -63.73 -41.12 98.11 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.194 179.666 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 21.1 m-70 -77.49 115.88 17.61 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 175.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.411 ' HD2' ' N ' ' A' ' 22' ' ' ARG . 8.3 mpt_? -53.15 -35.26 59.56 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 120.86 0.362 . . . . 0.0 110.667 -177.852 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -66.25 -42.99 87.76 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.378 177.521 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -65.68 -50.51 53.66 Favored Glycine 0 C--N 1.335 0.483 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.877 179.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 11.5 tp -47.83 -51.59 22.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.367 0.603 . . . . 0.0 110.584 174.514 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.505 ' O ' ' HG3' ' A' ' 30' ' ' ARG . 12.8 tp10 -65.03 -40.25 94.56 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.77 -176.7 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.07 -41.76 98.5 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.046 0.451 . . . . 0.0 110.629 178.281 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 83.5 t80 -71.71 -45.57 61.4 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.152 -176.201 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.635 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 9.0 t -60.79 -45.27 95.05 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 120.937 -0.305 . . . . 0.0 110.399 -177.788 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.505 ' HG3' ' O ' ' A' ' 26' ' ' GLU . 73.8 mtt-85 -58.92 -40.48 84.67 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.017 0.437 . . . . 0.0 109.988 178.361 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.525 ' O ' HG22 ' A' ' 34' ' ' THR . 94.5 t80 -63.92 -30.88 71.93 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.479 177.549 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.482 HD23 HG22 ' A' ' 41' ' ' ILE . 18.9 tp -85.72 -20.11 29.82 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.464 -179.028 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.635 ' HG3' ' O ' ' A' ' 29' ' ' THR . 66.1 mttm -77.6 -36.14 52.11 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.018 178.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.525 HG22 ' O ' ' A' ' 31' ' ' PHE . 14.8 t -63.81 -29.96 71.1 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 120.884 0.373 . . . . 0.0 110.972 -177.919 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -91.99 2.77 56.34 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.412 177.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 89.9 m-85 55.96 47.22 20.41 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.318 179.176 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 20.3 t -131.17 15.17 5.14 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.466 176.188 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.428 ' HB2' ' OE1' ' A' ' 42' ' ' GLU . 0.1 OUTLIER -57.16 -24.25 53.06 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 115.172 -0.922 . . . . 0.0 111.199 -179.374 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.453 ' O ' ' HB2' ' A' ' 43' ' ' PHE . 11.4 pt-20 -40.13 -36.06 0.46 Allowed 'General case' 0 C--O 1.225 -0.236 0 CA-C-N 115.205 -0.907 . . . . 0.0 112.161 178.442 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.456 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 46.5 m-80 -66.95 -62.17 1.57 Allowed 'General case' 0 C--O 1.245 0.816 0 CA-C-O 121.07 0.462 . . . . 0.0 111.528 -176.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.521 HD13 ' HB ' ' A' ' 29' ' ' THR . 13.1 tt -62.43 -44.09 98.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.194 -176.608 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.428 ' OE1' ' HB2' ' A' ' 38' ' ' GLU . 0.9 OUTLIER -63.17 -31.5 72.66 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.071 177.365 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.456 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 76.3 t80 -55.93 -60.77 2.99 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 120.706 0.288 . . . . 0.0 110.828 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.51 ' HB2' ' HG3' ' A' ' 105' ' ' GLN . 28.6 p-90 -78.05 -11.16 59.89 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 119.722 -0.791 . . . . 0.0 111.929 -176.15 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.481 HG13 ' O ' ' A' ' 41' ' ' ILE . 54.2 mt -68.66 -39.68 80.68 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 168.2 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.55 -32.37 73.99 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.898 174.157 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.413 ' O ' ' HB3' ' A' ' 50' ' ' PHE . 43.4 t -66.54 -28.78 68.81 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.583 175.792 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.521 ' O ' ' HG3' ' A' ' 51' ' ' LYS . 4.3 tm-20 -72.81 -40.08 66.13 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 177.134 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -65.04 -33.75 76.79 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.821 174.575 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . 0.413 ' HB3' ' O ' ' A' ' 47' ' ' CYS . 74.0 t80 -60.67 -58.73 7.23 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.901 177.017 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.521 ' HG3' ' O ' ' A' ' 48' ' ' GLU . 0.0 OUTLIER -63.29 -20.75 65.76 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 116.615 -0.266 . . . . 0.0 111.491 -179.139 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -72.05 -26.81 62.33 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.893 0.378 . . . . 0.0 110.685 177.216 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 42.7 m -66.65 106.86 1.93 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.996 -177.124 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.24 -4.84 56.95 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.929 179.788 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -80.43 117.04 4.37 Favored Glycine 0 CA--C 1.52 0.373 0 N-CA-C 111.529 -0.628 . . . . 0.0 111.529 175.775 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -50.82 -46.53 29.86 Favored 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 122.921 2.414 . . . . 0.0 112.687 -177.191 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 7.3 pm0 -71.57 -33.2 68.89 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.037 0.446 . . . . 0.0 109.946 179.562 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -62.2 -36.62 82.47 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.981 -177.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . 0.434 HG22 ' HG2' ' A' ' 96' ' ' PRO . 71.5 mt -53.89 -43.62 57.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.471 176.789 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 68.7 m-70 -63.66 -43.88 95.43 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.192 178.784 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 53.6 mt -64.59 -49.37 71.4 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.138 -175.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -56.48 -50.87 70.5 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.205 179.151 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.97 -41.64 98.24 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.049 -179.686 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 50.5 tptt -59.53 -45.33 92.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.463 -179.534 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.18 -56.18 21.26 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.636 179.099 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 71.0 mt -57.67 -37.08 57.18 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.481 -179.461 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.457 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 86.1 t80 -58.38 -60.82 3.19 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.54 -179.446 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -82.87 -1.05 50.99 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.911 -171.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 57.5 tptt -105.82 -31.76 8.69 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.748 -0.206 . . . . 0.0 111.008 178.238 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 81.2 m-85 -130.01 -43.5 1.2 Allowed 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 -172.242 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.457 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 48.2 mm -77.93 -32.88 17.92 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 CA-C-O 121.046 0.451 . . . . 0.0 111.711 -173.477 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.546 ' HB3' ' HB2' ' A' ' 75' ' ' ALA . 7.0 tp60 -77.02 144.49 38.62 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.196 -173.824 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 89.4 m -71.64 -34.98 70.24 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.826 -178.37 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . 0.407 ' H ' ' HG3' ' A' ' 72' ' ' GLN . 3.1 p30 -87.73 10.58 17.82 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 120.91 0.386 . . . . 0.0 110.747 177.21 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.546 ' HB2' ' HB3' ' A' ' 72' ' ' GLN . . . -69.91 154.11 94.93 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.528 179.15 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -55.18 -28.69 62.66 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.668 2.245 . . . . 0.0 112.25 178.536 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 17.9 tppt? -107.3 -69.51 0.84 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.488 -178.095 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 63.07 108.17 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.273 0.559 . . . . 0.0 110.023 -170.48 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 48.9 t -93.9 155.61 3.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.357 -176.515 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.486 ' HB2' HD21 ' A' ' 111' ' ' LEU . 45.0 m-80 -78.02 48.45 0.72 Allowed 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.238 0.542 . . . . 0.0 110.8 -179.746 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.416 HD11 HG21 ' A' ' 85' ' ' THR . 23.4 tp -79.45 151.7 30.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.382 179.291 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -53.88 137.53 38.54 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.827 -179.815 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 28.8 p90 -59.02 -45.75 89.94 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.438 -176.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 83.3 t60 -69.9 -30.83 68.36 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.764 0.316 . . . . 0.0 110.675 -176.662 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.416 HG21 HD11 ' A' ' 81' ' ' LEU . 39.3 m -64.8 -50.28 67.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.434 179.484 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.426 ' O ' HG23 ' A' ' 90' ' ' THR . 16.0 ptpt -71.66 -24.1 61.79 Favored 'General case' 0 CA--C 1.527 0.077 0 C-N-CA 120.76 -0.376 . . . . 0.0 110.713 -179.568 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -55.52 -53.88 50.83 Favored 'General case' 0 N--CA 1.462 0.161 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 173.512 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 53.1 t -56.77 -45.61 83.03 Favored 'Isoleucine or valine' 0 C--O 1.234 0.254 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.328 178.016 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 71.9 mt -59.4 -47.64 89.92 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.21 -178.527 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.426 HG23 ' O ' ' A' ' 86' ' ' LYS . 66.6 p -62.83 -27.06 69.06 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 120.867 0.365 . . . . 0.0 111.052 -178.173 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 82.3 m-20 -90.87 -14.2 32.21 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.459 -179.033 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 14.4 m -118.04 -0.01 11.74 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 111.804 0.298 . . . . 0.0 111.804 -176.071 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 7.8 tp -59.9 -23.26 26.19 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 CA-C-O 120.802 0.334 . . . . 0.0 111.337 -177.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . 0.569 HG23 ' HG2' ' A' ' 95' ' ' GLN . 5.9 t -59.79 -32.71 70.86 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.855 178.749 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.569 ' HG2' HG23 ' A' ' 94' ' ' THR . 11.7 pt20 -165.05 93.02 0.92 Allowed Pre-proline 0 CA--C 1.533 0.32 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.051 177.443 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . 0.434 ' HG2' HG22 ' A' ' 59' ' ' ILE . 94.2 Cg_endo -81.8 158.24 18.61 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.82 2.347 . . . . 0.0 112.594 -178.719 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 25.0 p -84.28 173.83 10.66 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.955 177.725 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . 0.488 ' H ' HD22 ' A' ' 98' ' ' LEU . 3.4 mm? -49.62 -43.77 46.85 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 123.208 0.603 . . . . 0.0 112.485 -172.87 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 -129.11 28.74 5.25 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.208 -173.588 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 6.3 p -46.09 -36.15 5.56 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 112.967 0.729 . . . . 0.0 112.967 -173.685 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -82.06 18.81 1.26 Allowed 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -177.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -70.64 -37.76 73.78 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 121.13 0.49 . . . . 0.0 109.899 179.028 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . 0.439 ' O ' ' HG2' ' A' ' 107' ' ' ARG . . . -61.72 -46.04 91.38 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.724 175.448 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.28 -40.99 96.16 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.493 178.278 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.51 ' HG3' ' HB2' ' A' ' 44' ' ' TRP . 30.4 tt0 -57.83 -45.82 85.63 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.621 177.663 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 18.5 m -63.27 -43.64 97.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.83 -179.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . 0.439 ' HG2' ' O ' ' A' ' 103' ' ' ALA . 20.5 mmt180 -58.14 -53.51 57.49 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.917 179.207 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.437 ' O ' ' SD ' ' A' ' 112' ' ' MET . 99.5 t -69.11 -35.9 70.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.457 -175.794 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . 0.41 ' HA ' ' HE1' ' A' ' 112' ' ' MET . 67.7 t80 -53.8 -54.55 36.72 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.031 0.444 . . . . 0.0 110.826 179.092 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 26.6 pt20 -73.85 -20.15 60.52 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.829 179.235 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . 0.486 HD21 ' HB2' ' A' ' 80' ' ' ASN . 35.6 tp -61.58 -49.66 75.74 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.257 -176.814 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . 0.505 ' HE3' ' HE1' ' A' ' 44' ' ' TRP . 0.0 OUTLIER -83.5 -29.63 27.81 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 120.312 -0.555 . . . . 0.0 110.263 177.529 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . 0.644 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 40.1 tt0 -52.36 -53.38 45.49 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 120.936 0.398 . . . . 0.0 110.721 179.188 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . 0.412 ' HG2' ' O ' ' A' ' 111' ' ' LEU . 29.8 pt20 -52.58 -18.95 1.98 Allowed 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 113.623 0.971 . . . . 0.0 113.623 -170.638 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . 0.583 ' O ' ' HG3' ' A' ' 119' ' ' ARG . 35.5 t70 -141.84 -52.86 0.43 Allowed 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 118.087 0.403 . . . . 0.0 111.68 -178.715 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 22.6 m -59.83 -31.76 70.03 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 120.665 0.269 . . . . 0.0 111.252 -178.801 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . 0.644 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 16.1 t80 -71.4 -42.75 67.94 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-O 120.647 0.261 . . . . 0.0 110.451 179.795 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 7.8 p -65.99 -35.54 80.87 Favored 'General case' 0 C--O 1.24 0.585 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.635 178.509 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . 0.583 ' HG3' ' O ' ' A' ' 115' ' ' ASP . 95.4 mtt180 -54.42 -51.13 65.9 Favored 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 172.266 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 79.6 t80 -58.39 -38.67 77.78 Favored 'General case' 0 C--O 1.225 -0.211 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.42 179.257 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 68.4 mt -62.95 -23.34 67.36 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.595 -179.272 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 2.4 tppp? -118.69 12.27 13.01 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.099 0.476 . . . . 0.0 111.311 177.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 95.2 p -71.17 146.81 48.88 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 176.245 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -56.48 -30.39 62.88 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 176.752 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . 0.424 ' O ' ' HG ' ' A' ' 129' ' ' LEU . 78.5 mt -56.94 -54.51 29.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-N 115.138 -0.937 . . . . 0.0 110.335 175.712 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' TYR . . . . . 0.482 ' O ' ' HG2' ' A' ' 130' ' ' MET . 75.7 t80 -64.1 -38.23 90.3 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.442 -178.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 92.4 mt -61.87 -36.1 80.25 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.166 177.535 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -70.6 -32.51 69.9 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.112 176.841 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' A' ' 125' ' ' ILE . 95.9 mt -72.29 -26.82 62.11 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.503 176.43 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' MET . . . . . 0.482 ' HG2' ' O ' ' A' ' 126' ' ' TYR . 27.2 mmt . . . . . 0 C--O 1.232 0.167 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 176.089 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . 0.49 HG21 ' CH2' ' A' ' 11' ' ' TRP . 2.6 p . . . . . 0 CA--C 1.529 0.136 0 CA-C-O 120.825 0.345 . . . . 0.0 110.973 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 34.4 m -114.6 155.75 45.65 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.645 177.117 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 80.5 Cg_exo -49.25 -37.11 39.05 Favored 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 122.91 2.407 . . . . 0.0 112.742 -178.401 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.448 ' O ' HG22 ' A' ' 9' ' ' VAL . 5.3 mp0 -64.62 -36.32 83.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.857 179.333 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.456 ' HB3' HG23 ' A' ' 3' ' ' VAL . 25.8 tp10 -68.37 -36.03 78.6 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 175.765 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.93 -41.38 91.43 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.338 179.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.448 HG22 ' O ' ' A' ' 6' ' ' GLU . 19.4 m -70.55 -23.24 24.19 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 CA-C-O 120.895 0.378 . . . . 0.0 110.29 178.717 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.48 ' O ' ' HD2' ' A' ' 17' ' ' LYS . 67.4 mmtt -67.13 -39.34 86.61 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-O 121.077 0.465 . . . . 0.0 109.847 171.68 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . 0.49 ' CH2' HG21 ' A' ' 3' ' ' VAL . 47.1 m0 -62.74 -27.09 69.04 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 175.075 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -72.42 -31.77 62.96 Favored Glycine 0 CA--C 1.52 0.358 0 CA-C-N 115.392 -0.822 . . . . 0.0 112.911 178.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' A' ' 10' ' ' LYS . 11.5 pt-20 -82.56 -23.11 34.65 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 117.147 0.474 . . . . 0.0 111.162 -178.941 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.522 ' HB2' ' HG2' ' A' ' 17' ' ' LYS . 49.8 m -152.22 107.68 3.3 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -179.619 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' PHE . . . . . 0.474 ' CD1' HD23 ' A' ' 18' ' ' LEU . 40.2 t80 -53.65 -27.42 27.3 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.55 175.49 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -59.2 -54.11 50.61 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.328 177.43 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.522 ' HG2' ' HB2' ' A' ' 14' ' ' SER . 17.7 ptpt -71.56 -20.08 62.07 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 120.937 -0.305 . . . . 0.0 110.599 -175.121 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.476 ' O ' ' HA3' ' A' ' 24' ' ' GLY . 48.9 tp -59.01 -48.95 79.75 Favored 'General case' 0 N--CA 1.463 0.183 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 169.656 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.503 HD23 ' CZ2' ' A' ' 44' ' ' TRP . 0.8 OUTLIER -77.44 -27.52 52.22 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.948 -179.539 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.5 ' HB3' ' HA ' ' A' ' 17' ' ' LYS . 9.7 t -74.61 -25.08 59.01 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.508 -178.125 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -92.15 126.79 37.38 Favored 'General case' 0 C--O 1.232 0.179 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 177.784 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 36.2 ttm180 -51.6 -39.71 58.49 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 120.739 0.304 . . . . 0.0 110.569 179.355 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -61.73 -40.55 95.47 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.051 179.212 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.476 ' HA3' ' O ' ' A' ' 18' ' ' LEU . . . -68.11 -48.94 50.43 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.855 -0.688 . . . . 0.0 111.517 -179.416 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 7.8 tt -58.23 -38.66 77.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.025 0.441 . . . . 0.0 110.07 174.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -61.22 -51.71 67.82 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.379 179.234 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -68.73 -32.95 73.1 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.916 179.468 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -73.73 -37.59 65.05 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.951 -176.284 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.457 ' O ' ' HB2' ' A' ' 33' ' ' LYS . 11.2 t -71.23 -44.39 65.43 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 121.027 -0.269 . . . . 0.0 110.58 -178.816 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 11.8 ptm180 -64.71 -32.73 74.53 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 120.847 0.356 . . . . 0.0 110.39 178.842 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 85.7 t80 -70.29 -55.73 8.48 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.205 177.338 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.443 HD23 ' HA ' ' A' ' 38' ' ' GLU . 25.5 tp -67.02 -16.5 64.4 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.996 -176.877 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.457 ' HB2' ' O ' ' A' ' 29' ' ' THR . 22.3 ttmm -69.6 -18.82 63.65 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.699 178.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 13.9 t -56.61 -26.32 55.35 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.038 0.447 . . . . 0.0 111.215 -179.145 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -124.59 8.12 8.28 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.39 179.376 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 53.37 41.22 32.14 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.583 176.761 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 50.5 m -107.49 20.51 18.8 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.937 179.551 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.443 ' HA ' HD23 ' A' ' 32' ' ' LEU . 6.6 pt-20 -69.3 -6.94 32.73 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.035 178.684 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -42.73 -38.4 2.07 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.049 171.113 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . 0.529 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 50.0 m-80 -64.75 -57.83 7.89 Favored 'General case' 0 C--O 1.245 0.831 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.568 -176.117 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.432 ' O ' HG13 ' A' ' 45' ' ' ILE . 9.8 tt -60.9 -41.05 87.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.13 -0.486 . . . . 0.0 109.822 -177.85 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.529 ' HA ' ' HB ' ' A' ' 45' ' ' ILE . 53.7 mt-10 -67.14 -30.14 70.05 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.859 178.213 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.529 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 81.4 t80 -54.49 -60.71 2.99 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.559 179.16 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' TRP . . . . . 0.626 ' HA ' ' SG ' ' A' ' 47' ' ' CYS . 26.4 p-90 -79.8 -14.51 58.64 Favored 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 119.357 -0.937 . . . . 0.0 111.614 -178.645 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ILE . . . . . 0.529 ' HB ' ' HA ' ' A' ' 42' ' ' GLU . 18.4 mt -62.99 -38.72 82.75 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 168.612 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.93 -36.27 82.91 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.872 174.226 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.626 ' SG ' ' HA ' ' A' ' 44' ' ' TRP . 64.3 m -61.51 -31.08 71.06 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.726 176.566 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.501 ' HG2' ' O ' ' A' ' 44' ' ' TRP . 9.2 mm-40 -73.82 -38.21 64.62 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 120.968 0.413 . . . . 0.0 109.899 176.398 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -57.74 -35.95 71.4 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.409 0.623 . . . . 0.0 109.9 174.446 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 51.0 t80 -72.46 -45.28 60.23 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 114.862 -1.063 . . . . 0.0 110.398 174.371 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.464 ' HB3' ' HA ' ' A' ' 48' ' ' GLU . 4.1 tmtm? -54.73 -38.27 66.92 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.635 -0.711 . . . . 0.0 112.502 -176.631 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 22.9 pttm -72.74 -21.19 61.06 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.043 0.449 . . . . 0.0 110.792 -176.318 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 22.7 m -81.46 75.79 8.41 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.187 -177.427 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.88 -5.99 42.03 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.943 -176.07 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -73.65 125.96 9.55 Favored Glycine 0 CA--C 1.521 0.414 0 C-N-CA 121.142 -0.552 . . . . 0.0 112.258 177.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.444 ' O ' ' HD2' ' A' ' 60' ' ' HIS . 89.0 Cg_exo -48.0 -46.53 21.75 Favored 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 123.037 2.491 . . . . 0.0 112.84 -177.201 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -63.12 -42.3 99.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.625 -179.325 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -64.08 -36.7 84.88 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.578 -177.515 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 30.6 mm -51.96 -55.92 7.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.298 179.111 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.444 ' HD2' ' O ' ' A' ' 56' ' ' PRO . 61.2 m-70 -62.89 -38.76 92.18 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.947 -175.701 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 88.6 mt -69.16 -55.16 11.49 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.012 -178.069 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.478 ' HE2' ' HA ' ' A' ' 62' ' ' LYS . 7.4 mmpt? -59.83 -40.09 87.31 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.013 -178.201 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.12 -46.86 84.85 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.771 178.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 4.2 tppp? -66.04 -32.2 73.54 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.79 -179.63 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.03 -59.16 5.49 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 120.945 0.403 . . . . 0.0 110.25 177.565 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 65.5 mt -59.52 -35.19 57.62 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.331 178.315 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.403 ' CE1' HG22 ' A' ' 90' ' ' THR . 77.2 t80 -54.17 -63.22 1.22 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.944 -179.713 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -79.35 -9.6 59.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 0.0 112.185 -172.787 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 56.1 tptt -98.02 -33.34 11.22 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 111.627 0.232 . . . . 0.0 111.627 -179.743 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 69.9 m-85 -128.05 -43.86 1.48 Allowed 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -173.34 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 49.6 mm -67.82 -40.49 83.75 Favored 'Isoleucine or valine' 0 C--O 1.238 0.468 0 CA-C-O 120.912 0.387 . . . . 0.0 111.185 -173.853 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . 0.596 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . 15.8 mm100 -60.59 141.53 56.55 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.541 178.119 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 92.4 m -67.13 -53.25 32.36 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.543 -179.477 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -88.95 27.9 1.27 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.631 -179.506 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.596 ' HB2' ' HB2' ' A' ' 72' ' ' GLN . . . -62.28 160.04 35.27 Favored Pre-proline 0 CA--C 1.531 0.247 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.0 178.358 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -72.19 48.05 1.14 Allowed 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 123.136 2.557 . . . . 0.0 112.48 176.249 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -178.92 -59.0 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 178.07 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 69.86 126.48 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.756 -177.439 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 57.8 t -121.04 138.2 52.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.422 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.935 177.189 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 37.1 m-80 -75.08 86.05 2.35 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.509 0.671 . . . . 0.0 111.075 179.567 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 15.1 tp -125.58 151.92 45.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.102 -0.953 . . . . 0.0 109.974 178.395 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -57.49 135.37 56.61 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.397 179.293 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 81.6 m-85 -67.68 -42.65 81.75 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.06 -175.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 72.7 t60 -58.62 -31.89 68.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.965 0.412 . . . . 0.0 110.381 178.285 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 37.7 m -66.97 -46.54 74.32 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.741 178.346 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -69.68 -24.99 63.67 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.226 -179.419 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -59.24 -52.41 65.79 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.392 0.615 . . . . 0.0 109.892 174.504 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 91.6 t -59.52 -39.28 78.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.027 177.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 81.5 mt -63.41 -43.8 98.65 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.04 179.107 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' THR . . . . . 0.403 HG22 ' CE1' ' A' ' 67' ' ' TYR . 33.7 p -65.09 -23.68 67.23 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-O 120.828 0.347 . . . . 0.0 111.097 -178.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 39.2 m-80 -86.92 -21.76 26.09 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.897 176.065 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 28.2 t -99.35 -9.49 23.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.29 -177.345 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.4 tp -58.16 -26.29 29.03 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 CA-C-O 120.783 0.325 . . . . 0.0 111.665 -175.771 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 6.0 t -62.95 -44.59 95.66 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.103 -179.835 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -148.62 79.9 8.52 Favored Pre-proline 0 N--CA 1.464 0.225 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 179.853 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -84.73 155.11 11.76 Favored 'Trans proline' 0 N--CA 1.46 -0.454 0 C-N-CA 122.579 2.186 . . . . 0.0 112.104 179.164 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 25.2 p -89.63 169.67 11.12 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.387 175.675 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 9.0 mp -53.28 -27.79 24.57 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 122.818 0.447 . . . . 0.0 112.043 -175.396 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' HIS . . . . . 0.463 ' HD2' ' HB2' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -131.02 44.01 3.02 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.101 0.477 . . . . 0.0 110.118 177.224 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 34.7 t -57.49 -34.47 69.08 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.471 176.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 85.7 m-85 -81.88 14.68 2.59 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.367 -178.322 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' ASP . . . . . 0.414 ' HB2' ' O ' ' A' ' 99' ' ' HIS . 12.8 t70 -57.83 -44.2 86.32 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 120.831 0.348 . . . . 0.0 110.537 -178.725 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.34 -43.05 96.82 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 121.06 0.457 . . . . 0.0 110.751 177.511 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.68 -37.85 88.92 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.168 178.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' GLN . . . . . 0.611 HE21 ' HB2' ' A' ' 44' ' ' TRP . 34.3 tt0 -63.7 -45.05 91.74 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.137 178.232 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 36.5 m -57.74 -47.19 83.17 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.358 177.611 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 23.0 mmt180 -52.71 -62.66 1.51 Allowed 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.947 178.297 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' VAL . . . . . 0.436 HG13 ' HB3' ' A' ' 40' ' ' ASN . 80.8 t -60.23 -42.6 90.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.449 -176.118 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 49.9 t80 -56.44 -51.88 66.74 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.095 -178.246 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 5.2 pp0? -73.45 -23.9 60.16 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 116.785 -0.189 . . . . 0.0 111.427 -176.87 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 61.7 mt -67.61 -49.14 64.5 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.82 0.343 . . . . 0.0 110.235 175.637 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 49.7 mtm -64.34 -36.48 84.27 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 116.158 -0.474 . . . . 0.0 109.886 178.061 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . 0.595 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 44.7 tt0 -55.74 -65.69 0.55 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.631 179.64 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -62.0 -15.64 45.64 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 113.034 0.753 . . . . 0.0 113.034 -171.938 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -121.84 -61.95 1.45 Allowed 'General case' 0 N--CA 1.466 0.33 0 O-C-N 121.979 -0.45 . . . . 0.0 112.059 -176.002 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 2.6 m -68.74 -39.09 80.5 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.886 -177.018 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' TYR . . . . . 0.595 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 36.1 t80 -78.24 -37.81 44.42 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.986 -173.831 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 21.1 p -61.05 -48.94 79.4 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.219 0.533 . . . . 0.0 110.111 176.342 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 65.5 mtm180 -64.62 -34.33 78.02 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.39 176.236 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -61.27 -37.6 83.75 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.623 177.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.416 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 95.4 mt -63.66 -44.93 92.34 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.203 0.525 . . . . 0.0 110.606 177.546 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 23.0 tptp -92.13 5.02 51.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.696 -174.016 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 85.3 p -69.09 141.19 54.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.786 0.327 . . . . 0.0 110.918 178.84 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -56.07 -32.7 64.34 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.042 177.202 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -65.76 -36.86 78.58 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.237 179.592 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -74.44 -38.0 63.12 Favored 'General case' 0 C--O 1.233 0.192 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 177.059 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 95.8 mt -61.75 -28.43 69.43 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.972 175.836 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -69.4 -41.7 76.08 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.086 173.585 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 98.1 mt -63.41 -25.68 68.39 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.569 178.302 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' MET . . . . . . . . . . . . . 28.8 mmt . . . . . 0 C--N 1.33 -0.24 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.247 175.249 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 49.4 m . . . . . 0 N--CA 1.476 0.865 0 N-CA-C 110.266 -0.272 . . . . 0.0 110.266 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 56.5 ttp -64.69 106.0 1.1 Allowed 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -174.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 2.9 p -137.21 139.49 43.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.275 175.292 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.1 m -96.19 149.89 36.49 Favored Pre-proline 0 C--N 1.327 -0.37 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.046 178.05 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -51.0 -35.54 50.65 Favored 'Trans proline' 0 C--N 1.352 0.715 0 C-N-CA 122.88 2.387 . . . . 0.0 112.364 -179.178 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.53 ' O ' HG22 ' A' ' 9' ' ' VAL . 34.4 tt0 -59.78 -52.0 67.35 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.06 0.457 . . . . 0.0 110.408 176.678 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 32.8 tp10 -56.49 -39.22 72.91 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.641 177.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.96 -46.02 86.5 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 115.758 -0.656 . . . . 0.0 111.731 -179.075 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.53 HG22 ' O ' ' A' ' 6' ' ' GLU . 24.7 m -67.16 -28.32 42.24 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.388 0 CA-C-O 120.931 0.396 . . . . 0.0 110.229 -179.862 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -70.7 -32.05 69.13 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.227 175.725 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 53.2 m0 -66.4 -21.88 66.23 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 173.747 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -83.17 2.15 87.48 Favored Glycine 0 C--N 1.335 0.495 0 CA-C-N 115.707 -0.678 . . . . 0.0 112.915 -179.45 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -125.51 -41.33 2.02 Favored 'General case' 0 C--O 1.234 0.274 0 O-C-N 122.803 -0.234 . . . . 0.0 110.532 176.588 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.435 ' HB2' ' HB3' ' A' ' 17' ' ' LYS . 14.0 m -108.74 101.92 11.01 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 120.842 0.353 . . . . 0.0 110.983 -178.758 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -61.95 -39.7 93.02 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.459 -178.612 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -64.7 -31.63 72.94 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.525 178.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.435 ' HB3' ' HB2' ' A' ' 14' ' ' SER . 62.5 tttp -70.5 -35.07 73.01 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 179.633 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.4 tp -62.15 -48.0 82.03 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.025 173.568 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.408 ' O ' ' HB2' ' A' ' 25' ' ' LEU . 60.2 tp -65.93 -49.07 69.26 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.47 -0.786 . . . . 0.0 111.624 -177.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 44.1 m -67.33 -29.43 69.0 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.788 -173.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -76.67 119.78 20.95 Favored 'General case' 0 C--N 1.332 -0.154 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 179.539 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -51.61 -39.19 57.54 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-O 121.088 0.471 . . . . 0.0 110.632 -176.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -66.78 -38.33 86.33 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.12 -179.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -71.95 -50.17 19.44 Favored Glycine 0 C--N 1.333 0.382 0 CA-C-N 115.505 -0.77 . . . . 0.0 111.955 -178.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.408 ' HB2' ' O ' ' A' ' 19' ' ' LEU . 7.9 tt -52.0 -43.16 63.52 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 122.787 0.435 . . . . 0.0 110.112 175.501 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.495 ' O ' ' HG3' ' A' ' 30' ' ' ARG . 13.6 tp10 -58.12 -56.07 26.79 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.466 178.179 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -60.76 -40.78 93.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.333 -177.281 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 62.8 t80 -69.71 -43.6 72.05 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.785 -175.004 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.422 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 11.6 t -67.9 -41.21 83.04 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 121.075 -0.25 . . . . 0.0 110.732 -178.466 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.495 ' HG3' ' O ' ' A' ' 26' ' ' GLU . 58.7 mtp180 -62.16 -43.22 99.33 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.974 0.416 . . . . 0.0 110.235 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.585 ' O ' HG22 ' A' ' 34' ' ' THR . 87.0 t80 -64.45 -47.13 80.22 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.978 175.816 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.459 HD23 ' HA ' ' A' ' 38' ' ' GLU . 12.2 tp -64.95 -21.83 66.9 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.86 -175.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.422 ' HG3' ' O ' ' A' ' 29' ' ' THR . 38.8 mttp -68.06 -29.98 69.08 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.713 178.591 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.585 HG22 ' O ' ' A' ' 31' ' ' PHE . 3.6 t -65.7 -21.93 66.58 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 120.871 0.367 . . . . 0.0 110.647 -177.208 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -118.56 7.44 11.8 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.819 179.259 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 56.2 t80 58.24 19.17 5.97 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.864 175.051 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 42.2 m -79.27 0.7 27.65 Favored 'General case' 0 C--N 1.327 -0.384 0 O-C-N 121.985 -0.447 . . . . 0.0 110.636 -178.216 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.47 ' HA ' HG22 ' A' ' 41' ' ' ILE . 7.5 pt-20 -59.26 -22.88 61.8 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.61 176.661 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -53.21 -45.98 68.85 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.665 176.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.521 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 91.7 m-20 -64.4 -52.19 59.42 Favored 'General case' 0 C--O 1.241 0.654 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.633 -177.255 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.47 HG22 ' HA ' ' A' ' 38' ' ' GLU . 13.0 tt -61.46 -44.7 99.01 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.155 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.369 -177.259 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.51 ' HA ' ' HB ' ' A' ' 45' ' ' ILE . 40.9 mt-10 -73.26 -21.19 60.66 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.562 -0.29 . . . . 0.0 111.101 -179.779 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.521 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 37.1 t80 -58.16 -60.5 3.66 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 120.614 0.245 . . . . 0.0 110.34 175.27 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.576 ' HB2' ' HG2' ' A' ' 105' ' ' GLN . 47.1 p-90 -75.77 -18.78 59.41 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 119.893 -0.723 . . . . 0.0 111.35 -177.667 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.51 ' HB ' ' HA ' ' A' ' 42' ' ' GLU . 41.4 mt -63.62 -41.51 92.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 N-CA-C 109.25 -0.648 . . . . 0.0 109.25 169.656 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.07 -31.25 72.02 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.216 175.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.496 ' SG ' ' HA ' ' A' ' 44' ' ' TRP . 74.5 m -67.61 -32.73 73.66 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.433 176.812 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 55.0 mm-40 -71.52 -37.02 71.24 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 116.595 -0.275 . . . . 0.0 110.419 175.051 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -65.57 -36.74 84.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.422 0.629 . . . . 0.0 109.406 176.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.408 ' CZ ' HG23 ' A' ' 59' ' ' ILE . 50.4 t80 -62.67 -47.05 85.36 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 114.977 -1.01 . . . . 0.0 109.951 172.612 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.97 -22.72 65.88 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 115.386 -0.824 . . . . 0.0 111.163 178.405 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.433 ' HE2' ' HB3' ' A' ' 52' ' ' LYS . 32.4 ttpt -76.8 -18.45 58.41 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.916 -0.583 . . . . 0.0 111.032 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 22.6 t -66.39 159.51 26.78 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 121.11 0.481 . . . . 0.0 111.159 -176.111 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.3 15.95 2.59 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.743 179.089 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -104.13 105.77 2.66 Favored Glycine 0 CA--C 1.518 0.271 0 N-CA-C 111.096 -0.802 . . . . 0.0 111.096 177.022 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 78.2 Cg_exo -48.58 -50.49 12.27 Favored 'Trans proline' 0 C--N 1.35 0.613 0 C-N-CA 123.017 2.478 . . . . 0.0 112.863 -176.004 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 3.6 pp0? -65.89 -34.52 78.32 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 120.77 0.319 . . . . 0.0 110.888 177.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -68.07 -30.22 69.36 Favored 'General case' 0 N--CA 1.461 0.112 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.934 -179.124 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.408 HG23 ' CZ ' ' A' ' 50' ' ' PHE . 40.8 mm -56.88 -43.56 80.5 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.199 176.424 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 21.6 m-70 -69.65 -42.05 74.74 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.568 -179.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 85.9 mt -64.01 -44.55 92.26 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.802 -179.68 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 72.3 mmtt -66.79 -46.81 74.1 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.552 179.001 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.62 -40.24 91.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.223 -178.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 38.2 mmtm -65.72 -37.51 86.61 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.537 -0.301 . . . . 0.0 110.739 178.38 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.8 -53.95 46.41 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.089 0.471 . . . . 0.0 109.963 176.117 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.419 ' HA ' ' HD1' ' A' ' 70' ' ' PHE . 69.9 mt -59.6 -35.05 57.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.366 178.778 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.495 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 40.1 t80 -57.92 -68.13 0.27 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.215 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -67.56 -33.74 75.65 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.446 -173.375 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.488 ' HA ' ' HD2' ' A' ' 76' ' ' PRO . 88.1 tttt -86.58 -29.13 22.85 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.958 -0.565 . . . . 0.0 112.098 -172.544 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.419 ' HD1' ' HA ' ' A' ' 66' ' ' ILE . 96.1 m-85 -125.03 -53.4 1.64 Allowed 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 112.164 0.431 . . . . 0.0 112.164 -174.556 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.495 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 42.4 mm -64.28 -34.39 68.79 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -169.28 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.431 ' HA ' ' OE1' ' A' ' 72' ' ' GLN . 14.1 mm-40 -58.27 155.86 10.86 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.469 0.652 . . . . 0.0 111.968 -177.513 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.8 t -74.59 -28.65 61.01 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.009 179.233 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -87.51 -82.66 0.22 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.209 175.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . 57.19 158.66 0.08 OUTLIER Pre-proline 0 CA--C 1.542 0.636 0 N-CA-C 112.987 0.736 . . . . 0.0 112.987 174.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.488 ' HD2' ' HA ' ' A' ' 69' ' ' LYS . 64.2 Cg_endo -75.25 -16.34 19.72 Favored 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.31 2.006 . . . . 0.0 111.602 170.871 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -105.61 -51.81 2.93 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.418 177.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 64.51 93.59 0.06 Allowed 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.299 -175.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 65.5 t -86.29 141.92 13.79 Favored 'Isoleucine or valine' 0 C--O 1.237 0.443 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.759 -178.521 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 36.4 m-80 -78.14 23.41 0.28 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.42 -176.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 18.0 tp -65.57 142.81 57.97 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.964 177.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -48.57 140.11 8.52 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.64 -0.709 . . . . 0.0 112.067 -179.087 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.404 ' O ' ' HG2' ' A' ' 86' ' ' LYS . 84.3 t80 -61.1 -52.89 62.98 Favored 'General case' 0 C--O 1.231 0.118 0 CA-C-N 115.681 -0.69 . . . . 0.0 111.387 -176.171 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 57.3 t60 -59.43 -38.59 81.08 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.869 0.366 . . . . 0.0 110.641 -177.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.431 ' O ' HG13 ' A' ' 89' ' ' ILE . 41.0 m -66.25 -51.62 55.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.76 -179.372 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.558 ' O ' HG23 ' A' ' 90' ' ' THR . 18.1 ptmt -67.29 -25.61 66.13 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 116.566 -0.288 . . . . 0.0 110.594 -177.64 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -64.08 -52.45 59.25 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-O 121.479 0.657 . . . . 0.0 109.405 175.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 99.0 t -58.95 -37.01 64.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.306 177.24 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.431 HG13 ' O ' ' A' ' 85' ' ' THR . 72.8 mt -66.98 -45.04 88.05 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.288 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.222 179.365 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.558 HG23 ' O ' ' A' ' 86' ' ' LYS . 48.4 p -57.34 -26.12 60.47 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 120.987 0.423 . . . . 0.0 110.757 -178.712 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -87.8 -41.42 13.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.148 175.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 22.5 t -79.51 -0.92 35.3 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.615 -174.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.9 tp -74.57 -4.53 5.78 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 CA-C-O 120.848 0.356 . . . . 0.0 111.552 -177.294 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 4.5 t -65.11 -47.18 78.08 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 116.686 -0.234 . . . . 0.0 110.881 179.048 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -132.23 81.35 61.41 Favored Pre-proline 0 N--CA 1.466 0.369 0 CA-C-O 121.161 0.505 . . . . 0.0 110.341 175.676 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_endo -71.43 139.62 35.01 Favored 'Trans proline' 0 C--N 1.344 0.336 0 C-N-CA 122.746 2.298 . . . . 0.0 112.734 -176.601 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.441 ' H ' ' HB3' ' A' ' 100' ' ' SER . 35.4 p -87.18 172.93 9.55 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.419 173.509 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 41.7 tp -57.79 -36.61 72.42 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 121.189 0.519 . . . . 0.0 110.778 -179.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . 0.523 ' HB3' ' HB3' ' A' ' 102' ' ' ASP . 33.8 m-70 -113.28 38.87 2.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.12 177.174 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . 0.441 ' HB3' ' H ' ' A' ' 97' ' ' THR . 9.2 p -55.39 -38.78 69.34 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.053 0.454 . . . . 0.0 111.422 -179.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 62.3 m-85 -93.95 21.84 6.29 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.409 -177.342 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . 0.523 ' HB3' ' HB3' ' A' ' 99' ' ' HIS . 7.3 p-10 -63.99 -35.29 80.2 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 120.976 0.417 . . . . 0.0 110.192 -179.451 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.494 ' O ' ' HG2' ' A' ' 107' ' ' ARG . . . -63.42 -48.47 77.66 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.887 174.795 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -58.33 -43.1 88.07 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.505 179.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.576 ' HG2' ' HB2' ' A' ' 44' ' ' TRP . 0.9 OUTLIER -57.06 -53.16 61.27 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 115.401 -0.818 . . . . 0.0 109.778 178.397 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 47.4 m -58.47 -48.17 81.64 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.165 -178.793 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . 0.494 ' HG2' ' O ' ' A' ' 103' ' ' ALA . 29.9 mmt180 -56.64 -65.05 0.68 Allowed 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.958 0.409 . . . . 0.0 110.886 -178.578 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.421 ' O ' ' HG3' ' A' ' 112' ' ' MET . 63.5 t -58.46 -38.57 70.92 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.4 -174.184 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 86.8 t80 -56.52 -56.6 19.22 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.77 179.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 1.1 pp0? -75.29 -12.89 60.37 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.629 -0.259 . . . . 0.0 111.237 -177.375 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 107' ' ' ARG . 53.4 mt -72.8 -45.56 57.88 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 109.852 -0.425 . . . . 0.0 109.852 173.266 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . 0.421 ' HG3' ' O ' ' A' ' 108' ' ' VAL . 33.6 mtm -61.96 -34.81 76.81 Favored 'General case' 0 CA--C 1.52 -0.191 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 178.428 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . 0.564 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 3.9 tm-20 -56.81 -68.76 0.19 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.178 177.544 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -63.75 -19.43 64.95 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.866 -0.607 . . . . 0.0 112.305 -174.127 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -101.14 -71.33 0.71 Allowed 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 120.991 0.424 . . . . 0.0 111.523 -179.049 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 7.4 m -79.4 -33.54 42.64 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.068 -0.515 . . . . 0.0 112.136 -171.335 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . 0.564 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 41.4 t80 -75.24 -30.9 60.65 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.662 0.268 . . . . 0.0 110.773 -173.235 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 32.8 p -64.16 -56.21 16.38 Favored 'General case' 0 C--O 1.24 0.598 0 CA-C-O 120.991 0.424 . . . . 0.0 110.642 177.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 9.4 ptp85 -60.81 -32.48 71.84 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.021 177.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 91.8 t80 -60.77 -40.29 91.98 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.538 177.562 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.448 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 92.5 mt -71.62 -26.92 62.77 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.746 -178.318 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 16.4 tppt? -106.75 7.05 30.18 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 120.966 0.413 . . . . 0.0 111.342 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 86.9 p -74.8 156.61 36.33 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 110.249 -0.278 . . . . 0.0 110.249 178.454 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 4.3 p30 -58.74 -24.67 62.0 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.164 175.064 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 50.8 mm -61.92 -56.53 17.12 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.576 178.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 66.3 t80 -72.34 -37.75 68.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.548 -177.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 80.8 mt -63.81 -30.16 71.28 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.299 177.653 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -66.65 -38.73 87.48 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.091 174.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 98.8 mt -66.03 -28.59 68.98 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.301 176.069 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' MET . . . . . . . . . . . . . 26.6 mmt -79.82 -38.02 33.86 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.732 179.187 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 57.59 26.19 12.53 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.042 -177.069 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . -73.34 -93.05 0.11 Allowed Glycine 0 N--CA 1.448 -0.53 0 CA-C-N 115.712 -0.677 . . . . 0.0 112.393 -179.21 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 23.9 ptt180 -157.85 133.6 5.94 Favored Pre-proline 0 CA--C 1.531 0.249 0 CA-C-O 120.45 0.167 . . . . 0.0 111.196 -176.676 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo . . . . . 0 C--N 1.347 0.464 0 C-N-CA 122.883 2.389 . . . . 0.0 111.282 171.393 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 16.9 t . . . . . 0 N--CA 1.48 1.06 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 24.7 ptm -119.58 119.6 34.25 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.845 0.355 . . . . 0.0 110.468 178.362 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 13.3 p -83.89 155.98 3.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.35 178.183 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.7 m -66.11 135.62 95.16 Favored Pre-proline 0 CA--C 1.535 0.387 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.261 175.391 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -49.01 -29.58 16.01 Favored 'Trans proline' 0 C--N 1.354 0.864 0 C-N-CA 123.038 2.492 . . . . 0.0 112.281 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -52.61 -59.96 3.83 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.208 -0.905 . . . . 0.0 110.748 177.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.54 ' HA ' ' HB3' ' A' ' 10' ' ' LYS . 25.5 tt0 -79.82 -22.67 42.75 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.823 -177.614 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -56.9 -46.49 81.9 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-O 120.87 0.367 . . . . 0.0 110.304 176.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 33.7 m -76.16 -29.04 19.01 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.177 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.382 177.119 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.54 ' HB3' ' HA ' ' A' ' 7' ' ' GLU . 16.2 tppt? -65.08 -27.51 68.82 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.349 -0.387 . . . . 0.0 110.808 176.606 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 43.6 m0 -65.96 -27.52 68.22 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 120.682 0.277 . . . . 0.0 110.615 175.477 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -61.6 -12.55 34.23 Favored Glycine 0 CA--C 1.52 0.371 0 CA-C-N 115.728 -0.669 . . . . 0.0 114.209 -173.047 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.486 ' HG2' ' O ' ' A' ' 10' ' ' LYS . 12.0 pt-20 -104.36 -14.85 15.61 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 117.367 0.583 . . . . 0.0 111.901 -178.605 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.549 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 19.3 m -145.21 95.03 2.61 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-O 120.987 0.423 . . . . 0.0 111.901 -173.339 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.463 ' O ' ' HB3' ' A' ' 18' ' ' LEU . 15.9 t80 -54.86 -32.24 60.53 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 121.377 0.608 . . . . 0.0 109.884 175.122 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -57.15 -50.37 73.04 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.425 176.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.549 ' HG2' ' O ' ' A' ' 14' ' ' SER . 13.0 ptmm? -69.99 -22.86 63.09 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 120.81 -0.356 . . . . 0.0 110.081 -175.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.463 ' HB3' ' O ' ' A' ' 15' ' ' PHE . 62.8 tp -59.55 -54.7 43.47 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.128 -0.487 . . . . 0.0 109.917 174.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -68.44 -34.72 76.49 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.655 177.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.458 ' HB3' ' HA ' ' A' ' 17' ' ' LYS . 23.9 t -64.43 -25.09 67.86 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.508 179.376 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 16.2 t-80 -88.84 113.66 24.63 Favored 'General case' 0 C--O 1.223 -0.29 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 177.565 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 8.4 ptm180 -47.23 -45.27 23.38 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-O 120.782 0.325 . . . . 0.0 111.601 -176.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -67.59 -34.46 77.06 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.068 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -72.37 -41.67 51.67 Favored Glycine 0 C--N 1.331 0.282 0 N-CA-C 111.396 -0.682 . . . . 0.0 111.396 -179.194 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 7.3 tt -60.0 -41.85 93.0 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 174.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.457 ' O ' HG22 ' A' ' 29' ' ' THR . 30.2 tt0 -60.3 -55.5 32.95 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 115.938 -0.574 . . . . 0.0 109.77 176.676 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -56.75 -43.85 81.13 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.332 -178.301 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 80.2 t80 -68.45 -43.33 77.3 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.06 -176.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.457 HG22 ' O ' ' A' ' 26' ' ' GLU . 12.5 t -67.04 -35.7 80.47 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 120.665 -0.414 . . . . 0.0 110.083 -179.439 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.453 ' HG3' ' O ' ' A' ' 26' ' ' GLU . 43.4 mtp180 -64.74 -45.46 86.38 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-O 121.085 0.469 . . . . 0.0 109.753 176.23 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 80.1 t80 -62.43 -42.04 99.17 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.565 177.316 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.437 ' HA ' ' HB3' ' A' ' 35' ' ' GLU . 16.2 tp -75.42 -22.09 57.66 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.501 -176.438 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.531 ' HE2' ' HG3' ' A' ' 38' ' ' GLU . 1.5 mptm? -71.68 -47.26 55.36 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.013 174.31 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 14.5 t -73.46 -18.3 61.14 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 120.854 0.359 . . . . 0.0 110.085 177.538 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.437 ' HB3' ' HA ' ' A' ' 32' ' ' LEU . 10.2 tp10 -75.11 -25.05 58.2 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.318 171.445 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 33.9 t80 68.39 33.57 4.09 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.128 177.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 22.1 m -136.43 30.46 2.92 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.553 -178.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.531 ' HG3' ' HE2' ' A' ' 33' ' ' LYS . 0.1 OUTLIER -70.52 -11.49 60.96 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.009 -0.542 . . . . 0.0 111.193 -177.91 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -45.25 -37.32 4.58 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.275 176.372 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.621 HD21 ' HB2' ' A' ' 80' ' ' ASN . 4.4 m-20 -69.36 -50.54 45.26 Favored 'General case' 0 C--O 1.242 0.662 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.896 -178.671 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.471 HG22 ' O ' ' A' ' 38' ' ' GLU . 11.2 tt -64.83 -42.92 96.2 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 C-N-CA 121.021 -0.272 . . . . 0.0 110.281 -175.215 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.42 ' HA ' ' HB ' ' A' ' 45' ' ' ILE . 51.8 mt-10 -69.22 -25.36 64.27 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 116.433 -0.348 . . . . 0.0 110.482 178.783 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.502 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 78.1 t80 -57.54 -60.9 2.96 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.726 178.38 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.731 ' HA ' ' SG ' ' A' ' 47' ' ' CYS . 43.1 p-90 -78.78 -17.01 56.44 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 119.779 -0.769 . . . . 0.0 111.82 -178.336 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.42 ' HB ' ' HA ' ' A' ' 42' ' ' GLU . 30.7 mt -63.85 -38.51 82.53 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 168.268 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.71 -34.69 67.3 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.1 178.474 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.731 ' SG ' ' HA ' ' A' ' 44' ' ' TRP . 18.2 p -72.25 -23.67 61.25 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-O 120.562 0.22 . . . . 0.0 110.502 -179.252 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -67.97 -52.46 35.72 Favored 'General case' 0 CA--C 1.521 -0.139 0 N-CA-C 109.124 -0.695 . . . . 0.0 109.124 170.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -55.92 -27.72 53.55 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.795 -0.638 . . . . 0.0 110.311 175.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.559 ' HA ' ' HD2' ' A' ' 62' ' ' LYS . 49.9 t80 -69.62 -50.35 45.23 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.991 178.052 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 64.8 pttt -72.52 -21.14 61.23 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 121.252 0.548 . . . . 0.0 110.157 178.684 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -74.68 -38.32 62.43 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.959 -176.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.8 p -63.24 128.68 36.93 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 120.905 0.383 . . . . 0.0 110.319 176.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -102.35 -1.75 30.29 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.206 -174.694 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -88.38 115.1 4.34 Favored Glycine 0 CA--C 1.521 0.457 0 C-N-CA 121.109 -0.567 . . . . 0.0 111.848 177.677 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -53.69 -33.84 71.45 Favored 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 122.886 2.391 . . . . 0.0 112.374 -178.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 58.2 mt-30 -65.47 -49.26 69.74 Favored 'General case' 0 C--O 1.235 0.33 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.598 178.355 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -59.2 -38.53 80.12 Favored 'General case' 0 N--CA 1.461 0.109 0 CA-C-N 115.0 -1.0 . . . . 0.0 110.534 179.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.425 ' O ' ' HE1' ' A' ' 50' ' ' PHE . 43.1 mm -54.38 -53.83 26.93 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.039 178.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.494 ' HA ' ' HG2' ' A' ' 96' ' ' PRO . 17.6 m-70 -63.39 -46.95 84.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.317 -176.325 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 88.8 mt -67.52 -44.05 79.33 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.114 -176.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.559 ' HD2' ' HA ' ' A' ' 50' ' ' PHE . 40.1 ttmt -64.17 -41.01 97.3 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.543 -178.819 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.26 -41.1 92.54 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.416 178.122 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 65.5 tttm -65.88 -38.06 87.79 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.128 178.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.18 -52.14 64.98 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.385 176.623 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 75.4 mt -59.34 -35.99 61.38 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 CA-C-O 121.257 0.551 . . . . 0.0 110.014 178.136 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 90.2 t80 -58.43 -60.95 2.99 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.58 178.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -70.19 -18.21 63.18 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.886 -174.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 85.4 tttt -97.24 -28.76 13.93 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 111.887 0.328 . . . . 0.0 111.887 -174.509 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 70.9 m-85 -130.83 -46.45 1.04 Allowed 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 -173.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 48.0 mm -74.51 -34.2 34.89 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 CA-C-O 121.085 0.469 . . . . 0.0 111.392 -173.296 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.56 ' NE2' ' HB3' ' A' ' 74' ' ' ASP . 0.0 OUTLIER -61.39 137.47 58.24 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.328 -174.386 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 22.9 m -66.01 -24.22 66.72 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 121.387 0.613 . . . . 0.0 109.67 174.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.56 ' HB3' ' NE2' ' A' ' 72' ' ' GLN . 20.8 t70 -106.05 86.26 2.34 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 169.763 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -137.95 152.49 72.25 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.122 -179.517 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_exo -46.8 -48.81 13.4 Favored 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 123.124 2.55 . . . . 0.0 112.857 -178.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.429 ' O ' ' HB2' ' A' ' 78' ' ' GLU . 94.0 mttt -116.32 -37.0 3.86 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.219 178.755 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.429 ' HB2' ' O ' ' A' ' 77' ' ' LYS . 44.0 mt-10 66.49 -177.47 0.2 Allowed 'General case' 0 C--O 1.234 0.279 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 -164.024 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.429 HG21 ' HD1' ' A' ' 43' ' ' PHE . 69.4 t -144.32 141.17 24.39 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 N-CA-C 110.339 -0.245 . . . . 0.0 110.339 177.463 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.621 ' HB2' HD21 ' A' ' 40' ' ' ASN . 34.7 m-80 -64.66 80.91 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.049 176.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 36.6 tp -127.5 143.73 51.15 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.432 -0.803 . . . . 0.0 109.741 179.011 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -50.38 132.2 24.62 Favored 'General case' 0 N--CA 1.466 0.371 0 O-C-N 123.427 0.454 . . . . 0.0 111.193 177.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -62.55 -38.2 89.13 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.911 -177.433 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.468 ' O ' HG23 ' A' ' 88' ' ' VAL . 84.7 t60 -65.41 -36.94 85.47 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 110.077 -0.342 . . . . 0.0 110.077 179.005 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 48.3 m -66.38 -41.39 89.46 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.127 175.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -60.95 -41.37 96.18 Favored 'General case' 0 N--CA 1.465 0.29 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 175.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -57.66 -44.1 85.46 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.656 178.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.468 HG23 ' O ' ' A' ' 84' ' ' HIS . 99.4 t -56.93 -44.74 82.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.114 176.203 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 71.8 mt -70.23 -38.19 73.81 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.321 -177.224 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 41.7 p -65.05 -26.67 68.35 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-O 120.682 0.277 . . . . 0.0 111.063 -177.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 47.8 m-80 -86.31 -46.05 10.67 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.897 175.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 21.8 m -82.01 -3.61 54.88 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 -173.72 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 7.9 tp -56.38 -23.07 15.82 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 CA-C-O 120.975 0.417 . . . . 0.0 111.342 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 11.6 t -64.1 -33.64 76.22 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.417 -179.081 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 17.2 mm-40 -140.5 76.64 24.72 Favored Pre-proline 0 N--CA 1.466 0.34 0 CA-C-O 120.748 0.309 . . . . 0.0 110.251 -178.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.494 ' HG2' ' HA ' ' A' ' 60' ' ' HIS . 72.0 Cg_endo -76.97 138.26 18.26 Favored 'Trans proline' 0 CA--C 1.531 0.371 0 C-N-CA 122.538 2.159 . . . . 0.0 112.085 179.776 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 5.8 m -105.82 162.72 13.3 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.422 -179.091 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.567 ' H ' HD22 ' A' ' 98' ' ' LEU . 3.9 mm? -15.75 -57.87 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 125.037 1.335 . . . . 0.0 114.006 -177.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 58.6 t60 -146.23 35.83 1.0 Allowed 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 114.874 -1.057 . . . . 0.0 109.593 -163.25 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 25.0 t -61.0 -10.99 6.68 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 114.973 -1.012 . . . . 0.0 112.071 -175.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 81.6 m-85 -87.34 14.64 7.59 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.805 -0.179 . . . . 0.0 111.221 178.289 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -59.01 -44.53 91.71 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 120.823 0.344 . . . . 0.0 110.811 -179.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.91 -42.07 97.33 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 121.221 0.534 . . . . 0.0 110.379 177.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.54 -39.34 91.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.631 179.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -60.47 -44.23 96.1 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.216 178.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 36.6 t -58.93 -52.12 67.1 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.729 -0.668 . . . . 0.0 110.326 178.191 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . 0.441 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 19.4 mmt180 -54.54 -61.37 2.35 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.159 -179.573 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.447 HG21 ' CD2' ' A' ' 43' ' ' PHE . 59.2 t -57.94 -46.43 87.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.417 0 CA-C-N 115.569 -0.742 . . . . 0.0 112.052 -173.785 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 68.3 t80 -57.71 -52.72 64.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.983 -178.384 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.441 ' HG3' ' O ' ' A' ' 107' ' ' ARG . 0.0 OUTLIER -71.93 -31.76 66.67 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.929 0.395 . . . . 0.0 110.887 -176.381 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 31.9 tp -68.94 -38.5 79.53 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.952 -175.109 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . 0.483 ' HB3' HD22 ' A' ' 40' ' ' ASN . 24.4 ptt? -82.4 -22.25 35.46 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 176.709 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . 0.689 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 37.2 tt0 -61.82 -59.61 4.88 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.141 178.27 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -49.14 -35.42 16.52 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.195 -176.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -104.92 -65.93 1.01 Allowed 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 -175.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 33.3 t -63.92 -36.57 84.38 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 111.698 0.258 . . . . 0.0 111.698 -173.139 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . 0.689 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 15.5 t80 -70.0 -40.23 75.41 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 120.453 0.168 . . . . 0.0 110.925 -177.867 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 28.8 p -65.63 -44.26 87.01 Favored 'General case' 0 C--O 1.241 0.648 0 CA-C-O 121.186 0.517 . . . . 0.0 109.966 176.27 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 75.1 mtp85 -57.24 -40.15 77.01 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 115.716 -0.674 . . . . 0.0 110.077 174.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -61.43 -40.76 95.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.095 176.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 89.8 mt -68.88 -8.96 48.88 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.202 179.286 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . 0.463 ' HD3' ' HA ' ' A' ' 122' ' ' LYS . 0.1 OUTLIER -130.65 20.32 5.11 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 120.917 0.389 . . . . 0.0 111.44 173.608 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 89.1 p -65.92 161.93 20.21 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.949 176.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 15.5 p-10 -62.76 -43.66 98.21 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.354 -179.49 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.404 ' O ' ' HG ' ' A' ' 129' ' ' LEU . 7.7 tp -62.61 -39.22 83.81 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.607 178.338 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' TYR . . . . . 0.443 ' O ' ' HG2' ' A' ' 130' ' ' MET . 58.0 t80 -66.8 -40.43 88.08 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 110.131 -0.322 . . . . 0.0 110.131 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 83.3 mt -61.74 -37.18 83.27 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.311 177.151 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -62.66 -43.17 99.5 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.188 175.153 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' A' ' 125' ' ' ILE . 95.1 mt -63.73 -30.0 71.15 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.606 176.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' MET . . . . . 0.443 ' HG2' ' O ' ' A' ' 126' ' ' TYR . 21.4 mmt -78.6 -27.8 45.62 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.619 177.74 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 44.45 22.84 0.06 Allowed 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 124.375 1.07 . . . . 0.0 112.989 179.454 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . -90.59 -24.87 27.09 Favored Glycine 0 C--N 1.331 0.251 0 N-CA-C 111.744 -0.542 . . . . 0.0 111.744 177.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 35.4 mmt180 -134.78 124.14 16.56 Favored Pre-proline 0 C--O 1.233 0.229 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 179.357 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo . . . . . 0 C--N 1.347 0.493 0 C-N-CA 122.551 2.167 . . . . 0.0 111.68 177.66 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 47.0 m . . . . . 0 N--CA 1.48 1.06 0 CA-C-O 120.584 0.23 . . . . 0.0 110.462 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 27.0 ptt? -159.1 169.92 23.16 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 120.745 0.307 . . . . 0.0 110.398 179.335 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 7.7 p -136.79 141.2 41.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.319 -179.511 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 34.8 t -88.91 148.11 40.51 Favored Pre-proline 0 C--N 1.327 -0.404 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 177.052 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_endo -48.62 -33.24 23.52 Favored 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 122.839 2.359 . . . . 0.0 111.869 179.286 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.567 ' O ' HG22 ' A' ' 9' ' ' VAL . 36.3 mt-10 -63.14 -54.16 42.02 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.143 178.035 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -63.3 -29.29 70.64 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.081 0.467 . . . . 0.0 109.959 178.03 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -68.22 -40.04 82.2 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.358 -179.348 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.567 HG22 ' O ' ' A' ' 6' ' ' GLU . 25.5 m -71.51 -21.92 21.75 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.269 0 C-N-CA 120.489 -0.484 . . . . 0.0 110.024 177.347 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.596 ' O ' ' HG2' ' A' ' 13' ' ' GLU . 5.6 mptp? -69.52 -16.37 63.42 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.852 173.186 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 42.8 m0 -80.3 -16.46 54.58 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.767 -0.456 . . . . 0.0 109.767 174.47 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -96.02 13.69 65.66 Favored Glycine 0 C--N 1.334 0.45 0 CA-C-N 115.708 -0.678 . . . . 0.0 112.858 -178.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.596 ' HG2' ' O ' ' A' ' 10' ' ' LYS . 11.5 pt-20 -111.78 -28.38 8.11 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 120.881 0.372 . . . . 0.0 110.457 175.708 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.8 m -152.6 117.51 5.12 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.322 -177.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 12.3 t80 -56.58 -36.84 69.8 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 172.223 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -52.19 -45.2 65.09 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 115.069 -0.969 . . . . 0.0 110.858 175.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.554 ' HD2' ' O ' ' A' ' 10' ' ' LYS . 40.4 ttmt -70.19 -36.29 74.52 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.301 179.753 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 67.3 tp -58.82 -43.41 90.64 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.078 176.259 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 51.5 tp -74.02 -34.71 64.22 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.574 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 33.6 t -63.81 -28.94 70.21 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.533 179.168 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.449 ' HB3' ' H ' ' A' ' 24' ' ' GLY . 1.5 m-70 -84.49 115.64 22.68 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 175.783 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.63 ' HB3' ' NH1' ' A' ' 22' ' ' ARG . 4.6 ttp-105 -56.49 -31.63 64.23 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.498 -0.556 . . . . 0.0 109.498 176.438 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -64.06 -46.71 83.16 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.339 -0.846 . . . . 0.0 109.397 176.38 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.449 ' H ' ' HB3' ' A' ' 21' ' ' HIS . . . -62.93 -44.62 97.14 Favored Glycine 0 N--CA 1.45 -0.393 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.658 179.309 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 13.3 tp -52.36 -57.39 9.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.144 0.497 . . . . 0.0 110.475 174.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 18.3 tp10 -58.74 -39.49 81.04 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-N 115.25 -0.886 . . . . 0.0 111.199 -175.434 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -71.4 -45.47 62.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.022 0.439 . . . . 0.0 110.976 179.017 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.478 ' O ' ' HG ' ' A' ' 32' ' ' LEU . 74.2 t80 -72.98 -30.28 63.69 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.226 -174.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 13.6 t -76.02 -39.09 56.44 Favored 'General case' 0 CA--C 1.519 -0.212 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 -177.748 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 37.2 ttt180 -59.72 -39.37 84.45 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.905 171.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.512 ' O ' HG22 ' A' ' 34' ' ' THR . 68.0 t80 -62.59 -53.45 54.39 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.822 -178.502 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.599 HD13 ' HA ' ' A' ' 38' ' ' GLU . 2.7 pp -73.91 -16.12 61.11 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 120.761 0.315 . . . . 0.0 111.406 -179.493 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.616 ' HD2' ' HB3' ' A' ' 38' ' ' GLU . 12.7 mptt -65.38 -50.23 66.32 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 120.962 0.41 . . . . 0.0 110.086 175.785 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.512 HG22 ' O ' ' A' ' 31' ' ' PHE . 13.8 t -68.66 -17.96 64.19 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.885 -174.262 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.557 ' HG2' ' HA ' ' A' ' 32' ' ' LEU . 12.5 pt-20 -97.56 8.76 44.05 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 120.736 0.303 . . . . 0.0 110.631 176.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 91.7 m-85 57.96 39.58 26.42 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.727 173.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 26.1 m -124.81 34.59 4.96 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.446 0.641 . . . . 0.0 109.3 177.179 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.616 ' HB3' ' HD2' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -83.43 -30.75 27.06 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.13 -0.941 . . . . 0.0 112.857 -170.079 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.437 ' HB3' ' NZ ' ' A' ' 77' ' ' LYS . 0.4 OUTLIER -57.71 -22.25 45.27 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 120.823 -0.351 . . . . 0.0 110.9 -177.058 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.538 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 58.1 m-80 -66.74 -50.46 62.69 Favored 'General case' 0 C--O 1.239 0.514 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.435 179.06 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.431 HG22 ' O ' ' A' ' 38' ' ' GLU . 13.9 tt -69.38 -40.67 80.31 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 C-N-CA 120.916 -0.314 . . . . 0.0 110.191 -178.751 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -61.69 -30.94 71.07 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.404 175.128 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.538 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 78.4 t80 -59.87 -66.58 0.49 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.405 179.603 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.643 ' HB2' ' HG3' ' A' ' 105' ' ' GLN . 47.2 p-90 -75.55 -18.5 59.75 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 120.176 -0.61 . . . . 0.0 112.516 -171.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 13.0 tt -73.39 -32.8 38.42 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 173.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.56 -27.69 65.34 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.927 -0.578 . . . . 0.0 109.904 174.346 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.506 ' SG ' ' HB2' ' A' ' 101' ' ' PHE . 41.4 t -68.83 -42.96 76.49 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.692 -0.685 . . . . 0.0 110.181 175.134 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 18.2 tp10 -65.1 -36.95 85.92 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 176.317 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.595 ' HA ' ' HE3' ' A' ' 52' ' ' LYS . 10.4 t70 -64.9 -38.26 90.38 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.378 173.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.491 ' HA ' ' HE2' ' A' ' 62' ' ' LYS . 8.5 t80 -56.15 -39.89 73.01 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.626 177.375 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.599 ' NZ ' ' HB2' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -97.47 -5.28 36.37 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.826 0.676 . . . . 0.0 112.826 -173.656 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.595 ' HE3' ' HA ' ' A' ' 49' ' ' ASP . 18.4 ptpt -74.38 -28.4 61.09 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 175.267 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.2 p -74.24 150.5 40.26 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.982 174.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.64 4.7 5.54 Favored 'General case' 0 N--CA 1.465 0.306 0 N-CA-C 111.678 0.251 . . . . 0.0 111.678 -177.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . 0.494 ' O ' HG12 ' A' ' 59' ' ' ILE . . . -75.12 120.44 6.2 Favored Glycine 0 CA--C 1.52 0.372 0 N-CA-C 111.169 -0.772 . . . . 0.0 111.169 175.652 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.45 ' O ' ' HD2' ' A' ' 60' ' ' HIS . 72.0 Cg_exo -49.0 -62.3 0.45 Allowed 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 122.878 2.386 . . . . 0.0 112.777 -175.498 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.83 -34.52 74.68 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-O 120.903 0.382 . . . . 0.0 110.519 -179.224 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.459 HE21 ' HD2' ' A' ' 62' ' ' LYS . 56.3 tp60 -60.65 -41.39 94.91 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.955 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.494 HG12 ' O ' ' A' ' 55' ' ' GLY . 44.2 mm -59.0 -41.44 83.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.683 179.096 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.45 ' HD2' ' O ' ' A' ' 56' ' ' PRO . 77.6 m-70 -64.95 -50.46 66.3 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.443 -177.237 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.458 HD12 ' N ' ' A' ' 62' ' ' LYS . 4.4 pp -70.54 -31.02 67.92 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.567 -0.288 . . . . 0.0 111.476 -175.309 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.491 ' HE2' ' HA ' ' A' ' 50' ' ' PHE . 60.5 mtpt -71.93 -41.73 67.49 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 120.777 0.323 . . . . 0.0 110.299 176.82 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.475 ' HB2' ' CE1' ' A' ' 50' ' ' PHE . . . -60.85 -44.69 96.67 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.691 178.427 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -65.51 -41.12 93.52 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.629 -177.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.99 -50.54 73.7 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-O 121.067 0.46 . . . . 0.0 110.567 177.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 70.1 mt -62.57 -38.19 80.85 Favored 'Isoleucine or valine' 0 C--O 1.231 0.127 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.327 178.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.577 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 49.1 t80 -55.74 -59.84 4.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.635 178.073 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -67.55 -24.61 65.55 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.427 -0.806 . . . . 0.0 112.603 -170.543 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 88.5 tttt -105.49 -25.41 12.34 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -176.051 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.529 ' HB3' ' HD1' ' A' ' 43' ' ' PHE . 96.4 m-85 -125.04 -46.12 1.83 Allowed 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 112.678 0.622 . . . . 0.0 112.678 -171.725 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.577 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 48.4 mm -71.04 -37.93 69.62 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 CA-C-O 120.944 0.402 . . . . 0.0 110.647 -173.473 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.405 ' OE1' ' HA ' ' A' ' 72' ' ' GLN . 5.8 tp60 -72.64 129.41 38.19 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.227 179.397 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 27.2 m -60.17 -44.1 95.31 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.204 0.526 . . . . 0.0 110.103 178.077 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -74.82 79.33 2.1 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.152 175.254 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -132.3 156.82 79.64 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.727 -175.588 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -67.74 -30.32 34.34 Favored 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 122.704 2.269 . . . . 0.0 112.259 -179.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.437 ' NZ ' ' HB3' ' A' ' 39' ' ' GLU . 26.0 tptp -105.0 -39.4 6.26 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.964 -0.562 . . . . 0.0 109.981 -179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.436 ' O ' ' HG3' ' A' ' 39' ' ' GLU . 51.5 mt-10 69.3 154.27 0.11 Allowed 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.297 -177.377 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.433 HG21 ' CD1' ' A' ' 43' ' ' PHE . 88.2 t -140.05 147.86 23.25 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 CA-C-N 115.685 -0.689 . . . . 0.0 109.496 175.603 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -86.79 87.75 7.52 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.122 0.487 . . . . 0.0 109.97 178.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.495 HD11 HG21 ' A' ' 85' ' ' THR . 37.3 tp -134.86 145.67 48.51 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.79 -177.853 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -54.73 158.9 2.42 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-N 115.683 -0.69 . . . . 0.0 112.487 -177.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 55.7 m-85 -73.69 -57.25 4.11 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.79 -177.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.447 ' O ' HG23 ' A' ' 88' ' ' VAL . 86.3 t60 -64.27 -31.03 72.08 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.996 -175.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.495 HG21 HD11 ' A' ' 81' ' ' LEU . 76.0 m -59.61 -51.76 68.43 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.67 179.205 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 9.7 ptpp? -71.24 -25.27 62.41 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.263 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -63.53 -41.64 98.47 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 121.231 0.539 . . . . 0.0 110.233 176.047 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 84' ' ' HIS . 81.3 t -64.06 -37.97 81.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 121.25 0.547 . . . . 0.0 109.66 174.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 75.6 mt -66.14 -40.3 86.71 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.258 -179.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.424 ' O ' HG22 ' A' ' 93' ' ' ILE . 40.2 p -61.78 -36.13 80.16 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 120.991 0.424 . . . . 0.0 110.376 179.483 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 28.7 m-80 -73.68 -29.23 62.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.903 175.316 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 50.5 m -94.8 -2.7 50.39 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -175.593 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.424 HG22 ' O ' ' A' ' 90' ' ' THR . 9.9 tp -61.35 -27.58 42.18 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.384 0 CA-C-O 120.874 0.369 . . . . 0.0 110.924 -177.269 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 15.0 t -78.97 -18.29 53.98 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.099 -178.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -140.58 75.66 26.01 Favored Pre-proline 0 N--CA 1.465 0.313 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.28 -179.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -75.08 143.07 28.36 Favored 'Trans proline' 0 C--O 1.236 0.377 0 C-N-CA 122.398 2.065 . . . . 0.0 111.688 178.391 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.495 HG22 ' H ' ' A' ' 98' ' ' LEU . 3.4 m -130.09 168.43 16.78 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 -178.701 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.495 ' H ' HG22 ' A' ' 97' ' ' THR . 3.2 mm? -64.71 3.73 0.49 Allowed 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 -170.119 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -157.14 19.72 0.3 Allowed 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 118.485 0.584 . . . . 0.0 111.854 174.301 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 30.0 m -55.21 -37.1 66.69 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 121.035 0.445 . . . . 0.0 111.789 -178.071 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.506 ' HB2' ' SG ' ' A' ' 47' ' ' CYS . 10.7 m-85 -89.79 16.89 7.27 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.519 -175.416 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -69.83 -32.96 71.67 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 120.85 0.357 . . . . 0.0 110.51 -177.606 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.9 -43.94 97.82 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-O 121.188 0.518 . . . . 0.0 109.943 176.148 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.13 -42.72 96.71 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.033 177.146 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.643 ' HG3' ' HB2' ' A' ' 44' ' ' TRP . 57.4 tt0 -57.34 -42.7 82.46 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.406 177.721 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 46.7 t -63.17 -53.22 56.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.996 -179.577 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . 0.436 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 20.0 mmm180 -57.21 -44.81 84.04 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.86 -174.342 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 57.7 t -77.26 -37.32 25.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.144 -175.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 7.5 t80 -60.57 -52.35 65.55 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.595 176.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.436 ' HG3' ' O ' ' A' ' 107' ' ' ARG . 0.0 OUTLIER -64.53 -31.31 72.47 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.064 0.459 . . . . 0.0 110.298 -178.745 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.414 ' HB2' ' O ' ' A' ' 107' ' ' ARG . 31.7 tp -65.74 -44.01 87.25 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.831 -176.579 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 28.1 mtm -72.49 -34.53 67.74 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 109.558 -0.534 . . . . 0.0 109.558 177.157 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . 0.602 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 7.1 tm-20 -57.56 -63.3 1.28 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.552 -178.328 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -54.8 -26.04 32.18 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.115 -0.493 . . . . 0.0 112.128 -174.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -103.66 -74.26 0.65 Allowed 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 120.803 0.335 . . . . 0.0 111.795 -176.459 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 15.6 t -64.84 -31.94 73.41 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.923 -170.442 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . 0.602 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 38.3 t80 -63.85 -40.88 97.6 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.617 0.246 . . . . 0.0 111.051 -176.743 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 63.5 p -61.72 -45.92 91.87 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-O 121.536 0.684 . . . . 0.0 109.965 179.177 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 52.8 mtp180 -59.58 -41.27 89.87 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.145 176.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 77.6 t80 -59.53 -34.2 72.34 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.46 179.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 94.5 mt -71.05 -26.01 62.9 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.161 178.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -115.89 21.43 13.82 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.393 177.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 97.9 p -75.7 152.21 37.53 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 120.645 0.26 . . . . 0.0 110.785 179.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -61.48 -29.14 69.78 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.353 0.597 . . . . 0.0 109.4 176.038 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.427 ' O ' ' HG ' ' A' ' 129' ' ' LEU . 45.2 mm -61.24 -52.93 55.69 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-N 115.087 -0.96 . . . . 0.0 110.21 174.343 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' TYR . . . . . 0.433 ' O ' ' HG2' ' A' ' 130' ' ' MET . 53.0 t80 -62.73 -38.74 91.68 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.587 -177.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 97.7 mt -60.77 -33.69 73.34 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.323 177.538 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -74.65 -34.3 62.7 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.373 177.192 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 125' ' ' ILE . 85.7 mt -71.26 -18.24 62.45 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.61 178.275 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' MET . . . . . 0.433 ' HG2' ' O ' ' A' ' 126' ' ' TYR . 21.6 mmt -75.67 -85.67 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.913 178.634 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 53.61 33.85 17.36 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.202 -176.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . -81.8 49.9 4.16 Favored Glycine 0 C--N 1.333 0.378 0 C-N-CA 121.306 -0.473 . . . . 0.0 112.152 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 20.0 tpt180 -75.26 112.03 16.63 Favored Pre-proline 0 CA--C 1.535 0.369 0 C-N-CA 123.067 0.547 . . . . 0.0 110.72 -178.323 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 82.8 Cg_endo . . . . . 0 C--N 1.346 0.412 0 C-N-CA 122.679 2.253 . . . . 0.0 111.769 177.244 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 50.5 p . . . . . 0 N--CA 1.476 0.868 0 CA-C-O 120.845 0.355 . . . . 0.0 110.754 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 4.5 ppp? -150.96 149.58 29.78 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 174.261 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.446 HG21 ' CZ2' ' A' ' 11' ' ' TRP . 7.1 p -105.81 137.88 33.67 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-O 120.88 0.371 . . . . 0.0 111.502 -175.775 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.7 m -76.83 151.54 82.32 Favored Pre-proline 0 C--O 1.236 0.362 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.334 176.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -53.59 -34.89 75.1 Favored 'Trans proline' 0 C--N 1.351 0.67 0 C-N-CA 122.877 2.385 . . . . 0.0 112.652 -177.192 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 46.3 mm-40 -60.48 -52.87 63.35 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.966 -179.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.533 ' HA ' ' HE2' ' A' ' 10' ' ' LYS . 22.1 tp10 -65.27 -37.8 88.31 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.074 178.565 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.07 -53.56 57.0 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.232 -179.554 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.797 HG12 ' SD ' ' A' ' 130' ' ' MET . 22.9 m -66.94 -25.55 34.68 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-O 121.26 0.553 . . . . 0.0 110.572 -179.589 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.551 ' HG2' ' HE2' ' A' ' 17' ' ' LYS . 35.2 ttpt -76.14 -9.52 58.69 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.396 -175.618 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.446 ' CZ2' HG21 ' A' ' 3' ' ' VAL . 45.9 m0 -66.98 -18.22 65.28 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.419 0.152 . . . . 0.0 111.1 177.773 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -76.26 60.87 3.13 Favored Glycine 0 C--N 1.333 0.374 0 CA-C-N 116.098 -0.501 . . . . 0.0 112.829 -177.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -150.74 -39.41 0.13 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.0 0.429 . . . . 0.0 110.34 176.322 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.413 ' HB3' ' OD1' ' A' ' 16' ' ' ASP . 69.3 m -142.1 125.08 16.17 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.678 -176.649 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.403 ' CZ ' ' SD ' ' A' ' 112' ' ' MET . 33.9 t80 -58.95 -40.21 84.01 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.028 178.489 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.413 ' OD1' ' HB3' ' A' ' 14' ' ' SER . 7.9 p-10 -64.66 -29.74 70.75 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.641 -0.708 . . . . 0.0 110.862 179.509 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.551 ' HE2' ' HG2' ' A' ' 10' ' ' LYS . 65.7 tttp -65.87 -38.22 88.21 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 121.163 0.506 . . . . 0.0 109.828 176.84 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.455 HD21 ' HB2' ' A' ' 28' ' ' PHE . 54.5 tp -59.91 -48.05 83.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.248 176.467 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -72.55 -25.56 61.4 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.178 179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 30.2 t -60.02 -27.73 67.15 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 121.326 0.584 . . . . 0.0 109.572 176.119 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 71.5 m-70 -100.46 118.9 37.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.52 176.272 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 92.4 mtt180 -64.48 -27.34 68.92 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.87 0.367 . . . . 0.0 110.083 179.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -65.21 -41.28 94.63 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.675 -0.693 . . . . 0.0 109.861 172.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -67.7 -45.73 73.62 Favored Glycine 0 C--N 1.331 0.274 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.522 178.479 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 7.7 tt -54.74 -42.6 71.8 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.166 -0.517 . . . . 0.0 110.003 175.457 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.487 ' O ' ' HG2' ' A' ' 30' ' ' ARG . 19.2 tp10 -58.03 -53.77 54.46 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.267 178.849 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -61.14 -40.2 92.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.832 -0.622 . . . . 0.0 111.262 -178.122 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.455 ' HB2' HD21 ' A' ' 18' ' ' LEU . 80.9 t80 -68.47 -48.7 63.82 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.201 -176.804 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 14.8 t -61.61 -34.51 75.78 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-O 120.72 0.295 . . . . 0.0 110.339 -177.44 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.487 ' HG2' ' O ' ' A' ' 26' ' ' GLU . 26.5 mmt180 -59.38 -52.0 67.49 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.335 176.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 62.5 t80 -64.35 -42.23 96.33 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.669 179.054 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.407 HD22 ' CE2' ' A' ' 28' ' ' PHE . 13.7 tp -65.55 -27.62 68.57 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.582 -176.036 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.563 ' HG2' ' HB3' ' A' ' 38' ' ' GLU . 56.9 mttm -75.13 -43.93 49.88 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.082 177.104 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 12.1 t -71.41 -17.95 62.37 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 120.93 0.395 . . . . 0.0 110.177 177.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -92.09 13.47 18.8 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.632 174.552 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 41.7 p90 46.61 22.75 0.19 Allowed 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.353 1.061 . . . . 0.0 112.87 178.258 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 24.4 m -107.98 18.28 21.42 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 121.102 0.477 . . . . 0.0 110.153 179.049 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.563 ' HB3' ' HG2' ' A' ' 33' ' ' LYS . 11.6 pt-20 -54.23 -19.88 5.99 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.824 -178.324 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -49.84 -48.02 51.27 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 116.011 -0.541 . . . . 0.0 110.906 176.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 10.1 m120 -57.42 -61.28 2.6 Favored 'General case' 0 C--O 1.244 0.799 0 CA-C-O 121.133 0.492 . . . . 0.0 111.878 -173.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.566 HG23 ' HG3' ' A' ' 42' ' ' GLU . 7.1 tp -56.3 -46.88 81.78 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.36 -177.467 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.566 ' HG3' HG23 ' A' ' 41' ' ' ILE . 46.9 mt-10 -78.6 -11.82 59.99 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.412 -176.333 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 78.4 t80 -70.74 -65.89 0.68 Allowed 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 116.561 -0.29 . . . . 0.0 110.32 177.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.487 ' HA ' ' SG ' ' A' ' 47' ' ' CYS . 22.8 p-90 -73.3 -19.51 61.02 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 119.6 -0.84 . . . . 0.0 111.484 -177.003 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 11.0 mt -60.56 -42.6 92.14 Favored 'Isoleucine or valine' 0 C--O 1.236 0.384 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 167.784 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.8 -28.73 62.75 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.914 178.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.509 ' O ' ' HB3' ' A' ' 50' ' ' PHE . 77.3 m -66.04 -37.06 84.9 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.798 179.233 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -77.93 -26.89 49.2 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.824 177.443 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.781 ' HA ' ' HE3' ' A' ' 52' ' ' LYS . 16.0 t70 -63.78 -39.37 94.08 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.577 0.703 . . . . 0.0 109.235 169.683 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.509 ' HB3' ' O ' ' A' ' 47' ' ' CYS . 91.4 t80 -61.51 -44.56 96.85 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.668 -1.151 . . . . 0.0 109.921 175.043 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.426 ' HA ' ' O ' ' A' ' 98' ' ' LEU . 23.7 ttpp -58.68 -39.22 80.07 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.6 -0.727 . . . . 0.0 111.831 -177.821 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.781 ' HE3' ' HA ' ' A' ' 49' ' ' ASP . 23.2 pttp -83.82 1.59 42.32 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 120.777 0.322 . . . . 0.0 111.647 -176.55 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 14.6 m -103.35 54.35 0.76 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 121.76 0.79 . . . . 0.0 108.934 175.265 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.93 -4.73 2.34 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.325 -1.307 . . . . 0.0 113.807 -167.511 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -61.24 116.27 9.1 Favored Glycine 0 C--O 1.224 -0.477 0 C-N-CA 120.533 -0.841 . . . . 0.0 111.25 177.554 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -44.72 -47.53 11.45 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 123.419 2.746 . . . . 0.0 113.133 -173.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.459 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 50.8 mt-30 -63.37 -50.66 69.06 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 121.021 0.439 . . . . 0.0 109.844 178.686 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -55.97 -37.65 69.35 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 115.3 -0.864 . . . . 0.0 110.599 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.5 HG23 ' CZ ' ' A' ' 50' ' ' PHE . 23.9 mm -57.74 -53.02 50.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.714 178.035 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 14.0 m-70 -63.38 -36.18 82.86 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.748 0.308 . . . . 0.0 110.682 -178.061 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.459 ' HG ' ' O ' ' A' ' 57' ' ' GLN . 88.5 mt -64.92 -50.56 66.0 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.931 -179.72 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -69.89 -36.47 75.45 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.872 -178.236 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.76 -48.24 82.68 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.674 179.553 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 20.3 tptp -68.38 -29.75 68.52 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.192 -179.266 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -65.81 -61.35 2.11 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.076 175.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 71.2 mt -55.2 -32.99 29.26 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.168 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.581 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.481 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 77.2 t80 -54.77 -66.16 0.45 Allowed 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.535 177.789 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.41 ' HG3' ' HD2' ' A' ' 67' ' ' TYR . 38.0 mt-10 -76.88 -12.34 59.95 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.911 -174.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 54.3 tptt -92.82 -32.84 14.49 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.247 -177.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.425 ' HB3' ' CG2' ' A' ' 79' ' ' VAL . 80.5 m-85 -133.49 -49.32 0.84 Allowed 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -172.934 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.481 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 49.8 mm -67.53 -28.25 41.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 CA-C-O 121.096 0.475 . . . . 0.0 111.071 -171.486 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.542 ' HB3' ' HB2' ' A' ' 75' ' ' ALA . 0.0 OUTLIER -65.49 125.9 26.62 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.493 178.677 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 25.0 m -58.38 -30.03 66.48 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 121.27 0.557 . . . . 0.0 110.426 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 42.1 m-20 -109.42 94.02 4.82 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 170.675 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.542 ' HB2' ' HB3' ' A' ' 72' ' ' GLN . . . -152.37 164.89 18.84 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-N 115.439 -0.801 . . . . 0.0 109.832 -176.244 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.403 ' HD2' ' HB1' ' A' ' 75' ' ' ALA . 82.1 Cg_exo -46.77 -45.35 20.44 Favored 'Trans proline' 0 C--N 1.357 0.974 0 C-N-CA 122.643 2.228 . . . . 0.0 112.299 178.556 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -130.51 89.96 2.85 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 173.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.412 ' O ' ' HG2' ' A' ' 78' ' ' GLU . 0.6 OUTLIER -68.6 117.19 10.02 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.437 -179.12 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.425 ' CG2' ' HB3' ' A' ' 70' ' ' PHE . 97.3 t -69.31 138.81 21.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.615 178.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -79.45 30.72 0.23 Allowed 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.151 179.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.437 HD11 HG21 ' A' ' 85' ' ' THR . 39.4 tp -75.06 146.03 41.84 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.706 -175.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -53.04 145.94 12.12 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.26 -0.882 . . . . 0.0 112.052 178.569 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.417 ' HA ' ' HG2' ' A' ' 86' ' ' LYS . 39.9 p90 -66.71 -38.97 87.79 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.38 -176.336 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 79.8 t60 -69.42 -35.02 75.31 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.842 0.353 . . . . 0.0 110.361 -179.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.437 HG21 HD11 ' A' ' 81' ' ' LEU . 21.4 m -70.34 -45.77 65.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.739 -179.56 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.487 ' O ' HG23 ' A' ' 90' ' ' THR . 19.3 ptpt -64.64 -31.12 72.2 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 178.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -58.73 -47.49 84.43 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.197 176.305 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 65.0 t -58.74 -43.08 87.04 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 CA-C-O 121.036 0.446 . . . . 0.0 110.284 177.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 65.0 mt -61.69 -46.9 95.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.17 -179.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.487 HG23 ' O ' ' A' ' 86' ' ' LYS . 78.8 p -60.26 -42.77 96.03 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-O 121.099 0.476 . . . . 0.0 110.864 -177.443 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -83.75 -7.01 59.57 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.96 -0.564 . . . . 0.0 112.143 -176.48 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 23.7 m -124.03 6.15 8.6 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 179.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 11.1 tp -67.25 -21.39 27.89 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 CA-C-O 120.999 0.428 . . . . 0.0 110.464 -178.031 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 9.9 t -58.73 -36.87 75.0 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.169 178.201 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -141.46 83.95 12.92 Favored Pre-proline 0 C--O 1.233 0.197 0 CA-C-O 120.953 0.406 . . . . 0.0 110.23 -179.379 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.464 ' HG2' HG22 ' A' ' 59' ' ' ILE . 86.2 Cg_endo -81.55 156.56 18.87 Favored 'Trans proline' 0 CA--C 1.532 0.411 0 C-N-CA 122.714 2.276 . . . . 0.0 112.298 178.771 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.405 ' H ' ' HB2' ' A' ' 100' ' ' SER . 62.8 p -86.78 -171.82 3.71 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.575 176.594 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.426 ' O ' ' HA ' ' A' ' 51' ' ' LYS . 34.8 tp -51.04 -37.43 45.35 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 121.189 0.519 . . . . 0.0 110.847 -177.621 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -152.29 76.84 1.18 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.586 0.708 . . . . 0.0 109.537 170.803 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . 0.405 ' HB2' ' H ' ' A' ' 97' ' ' THR . 13.1 t -58.83 -19.33 40.42 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 115.172 -0.922 . . . . 0.0 111.485 -176.346 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 75.9 m-85 -77.31 6.22 7.19 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.868 -179.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -52.16 -50.86 60.95 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 122.966 0.506 . . . . 0.0 111.034 177.631 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.422 ' O ' ' HD3' ' A' ' 107' ' ' ARG . . . -61.05 -42.58 98.75 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.535 179.253 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.19 -43.25 99.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.616 179.033 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 25.4 tt0 -54.53 -44.44 72.8 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.373 177.786 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . 0.439 ' O ' ' HG2' ' A' ' 110' ' ' GLN . 32.1 m -56.96 -47.47 80.62 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.512 179.712 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . 0.458 ' O ' ' HG ' ' A' ' 111' ' ' LEU . 12.5 mpt_? -62.9 -63.93 1.06 Allowed 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.548 178.602 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.485 ' O ' ' HG3' ' A' ' 112' ' ' MET . 80.2 t -50.82 -42.45 23.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.435 -175.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 32.5 t80 -56.99 -59.53 4.92 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.119 179.159 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.439 ' HG2' ' O ' ' A' ' 106' ' ' SER . 4.1 pt20 -71.26 -20.56 62.21 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-O 120.553 0.216 . . . . 0.0 111.455 -174.854 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' A' ' 107' ' ' ARG . 76.3 mt -69.65 -41.11 76.0 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.805 -0.18 . . . . 0.0 111.006 178.76 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . 0.485 ' HG3' ' O ' ' A' ' 108' ' ' VAL . 0.0 OUTLIER -91.55 -12.02 35.63 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 120.955 -0.298 . . . . 0.0 110.79 178.932 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . 0.512 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 42.5 tt0 -68.05 -56.71 7.88 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 171.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -58.28 -22.88 54.35 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 115.95 -0.568 . . . . 0.0 112.226 -176.157 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -110.91 -69.28 0.88 Allowed 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 120.976 0.417 . . . . 0.0 111.089 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . 0.48 ' HA ' ' HB3' ' A' ' 119' ' ' ARG . 22.1 m -69.58 -17.92 63.59 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 -168.805 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . 0.512 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 22.5 t80 -68.46 -60.44 2.43 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 118.116 0.417 . . . . 0.0 110.431 177.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 20.6 p -65.12 -34.47 78.47 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.314 0.578 . . . . 0.0 110.272 178.402 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . 0.48 ' HB3' ' HA ' ' A' ' 116' ' ' SER . 16.3 ttt180 -55.29 -46.8 76.2 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 114.953 -1.021 . . . . 0.0 109.472 173.313 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -65.62 -41.5 92.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.346 177.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.453 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 90.5 mt -58.21 -25.57 61.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.633 0.254 . . . . 0.0 111.21 -179.452 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 11.4 mptt -113.65 7.96 17.44 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 179.083 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 78.4 p -69.41 140.77 54.17 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 171.289 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -54.43 -33.49 59.58 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 111.522 0.193 . . . . 0.0 111.522 -179.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 9.9 tp -66.31 -40.81 87.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.425 0 CA-C-O 120.743 0.306 . . . . 0.0 110.878 -178.611 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' TYR . . . . . 0.535 ' O ' ' HG2' ' A' ' 130' ' ' MET . 84.7 t80 -72.17 -43.24 64.89 Favored 'General case' 0 C--O 1.232 0.176 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 176.349 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 91.4 mt -61.86 -23.79 66.5 Favored 'General case' 0 C--N 1.333 -0.132 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.199 177.351 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -68.58 -43.56 76.26 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.133 173.094 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 80.9 mt -61.65 -29.4 70.04 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.242 176.338 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' MET . . . . . 0.797 ' SD ' HG12 ' A' ' 9' ' ' VAL . 19.4 mmt -79.43 -65.27 1.02 Allowed 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.632 0.73 . . . . 0.0 110.498 -179.529 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -104.57 -34.65 8.12 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 114.773 -1.103 . . . . 0.0 112.177 -168.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 96.39 88.03 1.8 Allowed Glycine 0 C--O 1.237 0.326 0 N-CA-C 110.558 -1.017 . . . . 0.0 110.558 -171.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . 0.41 ' HA ' ' HD3' ' A' ' 134' ' ' PRO . 37.2 ttm180 -146.98 129.06 7.57 Favored Pre-proline 0 C--N 1.328 -0.369 0 C-N-CA 121.977 0.111 . . . . 0.0 111.012 -169.703 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 133' ' ' ARG . 12.3 Cg_exo . . . . . 0 C--N 1.348 0.527 0 C-N-CA 122.798 2.332 . . . . 0.0 111.684 173.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 17.0 m . . . . . 0 N--CA 1.476 0.866 0 N-CA-C 109.708 -0.479 . . . . 0.0 109.708 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 16.5 ptp -77.05 70.77 3.49 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 121.267 0.556 . . . . 0.0 111.491 -176.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.402 HG21 ' CH2' ' A' ' 11' ' ' TRP . 3.2 p -62.38 123.17 14.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.937 175.618 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 17.6 m -62.13 136.24 95.28 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.109 179.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.467 ' HA ' ' HB3' ' A' ' 8' ' ' ALA . 8.2 Cg_endo -49.72 -26.77 13.81 Favored 'Trans proline' 0 C--N 1.355 0.872 0 C-N-CA 123.186 2.591 . . . . 0.0 112.464 -178.149 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.594 ' O ' HG22 ' A' ' 9' ' ' VAL . 32.8 tt0 -58.53 -58.06 10.2 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.16 176.168 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -59.25 -37.1 76.75 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.252 0.548 . . . . 0.0 110.187 175.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.467 ' HB3' ' HA ' ' A' ' 5' ' ' PRO . . . -62.5 -39.75 94.5 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.663 -177.642 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.594 HG22 ' O ' ' A' ' 6' ' ' GLU . 27.0 m -72.1 -26.58 25.3 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.297 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.261 178.011 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.587 ' HG2' ' O ' ' A' ' 6' ' ' GLU . 14.4 mmmm -63.31 -38.15 90.03 Favored 'General case' 0 N--CA 1.463 0.207 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 174.702 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.402 ' CH2' HG21 ' A' ' 3' ' ' VAL . 54.0 m0 -61.33 -29.65 70.02 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.716 -0.675 . . . . 0.0 110.634 176.168 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -74.42 6.96 20.49 Favored Glycine 0 CA--C 1.521 0.443 0 CA-C-N 115.64 -0.709 . . . . 0.0 113.719 -176.308 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.502 ' HG3' ' O ' ' A' ' 10' ' ' LYS . 0.0 OUTLIER -132.49 12.0 4.5 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 117.475 0.638 . . . . 0.0 111.244 176.391 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.418 ' HB3' ' HG2' ' A' ' 17' ' ' LYS . 44.2 t -171.0 100.59 0.21 Allowed 'General case' 0 C--O 1.237 0.444 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.169 176.863 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.429 ' HD1' HD23 ' A' ' 18' ' ' LEU . 37.0 t80 -55.12 -29.02 56.82 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.36 176.418 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -57.59 -52.06 66.94 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.507 -0.77 . . . . 0.0 110.994 -179.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.418 ' HG2' ' HB3' ' A' ' 14' ' ' SER . 17.7 ptpt -74.42 -28.39 61.05 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 120.946 -0.302 . . . . 0.0 110.533 -174.837 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.429 HD23 ' HD1' ' A' ' 15' ' ' PHE . 16.4 tp -57.19 -51.36 69.62 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.018 173.893 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.554 HD12 ' HA ' ' A' ' 25' ' ' LEU . 15.7 tp -82.9 -22.54 33.9 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.821 -175.508 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 23.2 t -76.71 -25.73 53.91 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.278 178.21 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -73.59 120.87 19.79 Favored 'General case' 0 C--O 1.222 -0.347 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 177.911 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.441 ' O ' ' HB3' ' A' ' 25' ' ' LEU . 60.9 mtp180 -43.06 -56.65 3.25 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.226 0.61 . . . . 0.0 112.551 -173.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -72.56 -26.52 61.76 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.816 0.341 . . . . 0.0 110.469 -178.381 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -68.17 -34.55 81.18 Favored Glycine 0 C--N 1.333 0.397 0 N-CA-C 111.384 -0.686 . . . . 0.0 111.384 176.325 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.554 ' HA ' HD12 ' A' ' 19' ' ' LEU . 9.3 tp -58.31 -54.72 43.83 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.536 0.684 . . . . 0.0 109.505 174.423 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.482 ' O ' ' HG2' ' A' ' 30' ' ' ARG . 8.8 tp10 -61.59 -34.58 75.86 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 114.715 -1.13 . . . . 0.0 110.459 -179.408 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.543 ' O ' ' HB2' ' A' ' 30' ' ' ARG . . . -68.28 -52.25 35.87 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 121.053 0.454 . . . . 0.0 111.153 179.323 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -64.75 -39.54 93.8 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.656 -177.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.539 ' OG1' ' HE2' ' A' ' 33' ' ' LYS . 3.6 t -64.31 -33.25 75.4 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 -179.482 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.543 ' HB2' ' O ' ' A' ' 27' ' ' ALA . 67.1 mmt-85 -52.43 -51.2 60.4 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.295 0.569 . . . . 0.0 109.556 171.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.464 ' O ' HG22 ' A' ' 34' ' ' THR . 69.2 t80 -64.56 -46.81 81.19 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 114.991 -1.004 . . . . 0.0 110.864 -178.158 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.567 ' HG ' ' H ' ' A' ' 38' ' ' GLU . 23.1 tp -70.48 -23.23 62.64 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.418 -175.583 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.539 ' HE2' ' OG1' ' A' ' 29' ' ' THR . 68.4 mttm -86.1 -34.15 20.73 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.771 -0.195 . . . . 0.0 110.964 178.53 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.464 HG22 ' O ' ' A' ' 31' ' ' PHE . 14.3 t -72.37 -22.94 61.07 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 121.08 -0.248 . . . . 0.0 110.854 -178.202 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.434 ' CD ' HH12 ' A' ' 119' ' ' ARG . 12.6 pt-20 -88.27 5.04 43.66 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 120.978 0.418 . . . . 0.0 110.028 174.088 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 33.0 t80 68.7 26.93 6.05 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.63 174.073 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 50.1 m -91.96 -78.52 0.4 Allowed 'General case' 0 CA--C 1.532 0.264 0 O-C-N 122.06 -0.4 . . . . 0.0 110.016 176.312 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.567 ' H ' ' HG ' ' A' ' 32' ' ' LEU . 32.8 tt0 67.37 -64.61 0.25 Allowed 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 112.959 0.726 . . . . 0.0 112.959 175.667 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -39.32 -38.95 0.58 Allowed 'General case' 0 C--O 1.22 -0.484 0 C-N-CA 123.899 0.88 . . . . 0.0 113.061 -174.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.535 ' HB2' HD21 ' A' ' 32' ' ' LEU . 43.2 m-80 -50.43 -68.89 0.13 Allowed 'General case' 0 C--O 1.242 0.665 0 CA-C-O 121.062 0.458 . . . . 0.0 111.879 -176.668 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.493 HD12 HD11 ' A' ' 19' ' ' LEU . 3.7 tt -61.95 -44.33 98.76 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.857 -176.346 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -62.89 -31.59 72.68 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.081 -179.053 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 66.2 t80 -65.29 -66.71 0.51 Allowed 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.353 -177.209 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.498 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 33.6 p-90 -71.23 -23.97 62.1 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 119.707 -0.797 . . . . 0.0 111.805 -171.957 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 14.7 tt -66.85 -36.26 76.75 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 C-N-CA 120.213 -0.595 . . . . 0.0 109.592 177.1 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.0 -33.09 75.02 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 121.26 0.552 . . . . 0.0 109.887 173.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 72.5 m -70.4 -29.16 65.72 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.364 177.131 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.568 ' O ' ' HG3' ' A' ' 52' ' ' LYS . 37.0 mm-40 -72.93 -30.86 64.22 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 116.671 -0.24 . . . . 0.0 110.517 177.162 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.812 ' HA ' ' HE3' ' A' ' 52' ' ' LYS . 30.3 t70 -61.08 -42.18 98.03 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 172.126 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -63.46 -35.81 81.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.048 174.092 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.535 ' HB2' ' HA ' ' A' ' 48' ' ' GLU . 1.1 tppp? -59.28 -29.45 67.6 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.628 -0.715 . . . . 0.0 109.964 178.136 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.812 ' HE3' ' HA ' ' A' ' 49' ' ' ASP . 9.4 mtmp? -87.46 -19.6 27.77 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.104 -179.03 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 18.8 m -73.36 82.09 1.4 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.343 0.592 . . . . 0.0 111.102 -173.653 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.431 ' HD3' ' O ' ' A' ' 54' ' ' LYS . 0.0 OUTLIER -76.02 103.85 6.27 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.84 178.326 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . 0.524 ' O ' HG12 ' A' ' 59' ' ' ILE . . . 173.1 119.84 0.54 Allowed Glycine 0 N--CA 1.45 -0.406 0 N-CA-C 110.93 -0.868 . . . . 0.0 110.93 178.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_endo -55.35 -46.77 30.04 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.74 2.293 . . . . 0.0 112.348 -174.475 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.462 ' NE2' HE21 ' A' ' 58' ' ' GLN . 7.9 pm0 -67.75 -34.46 76.86 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.192 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.462 HE21 ' NE2' ' A' ' 57' ' ' GLN . 66.5 mm-40 -63.38 -40.76 98.11 Favored 'General case' 0 N--CA 1.462 0.14 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 179.149 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.525 HG22 ' HG2' ' A' ' 96' ' ' PRO . 47.3 mm -54.51 -42.03 57.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.907 -179.663 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 32.5 m-70 -67.57 -56.1 10.78 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.194 -178.161 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.476 HD12 ' N ' ' A' ' 62' ' ' LYS . 3.9 pp -73.2 -34.46 65.98 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 112.534 0.568 . . . . 0.0 112.534 -171.191 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.476 ' N ' HD12 ' A' ' 61' ' ' LEU . 47.1 mtpt -75.95 -40.72 53.41 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 120.869 -0.333 . . . . 0.0 110.675 179.506 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.15 -41.71 97.07 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.879 0.371 . . . . 0.0 110.228 177.393 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 15.9 tppt? -60.39 -41.51 93.97 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.855 177.314 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.26 -49.4 77.22 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.934 179.159 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 68.8 mt -64.95 -35.76 76.16 Favored 'Isoleucine or valine' 0 C--O 1.234 0.273 0 CA-C-O 121.229 0.538 . . . . 0.0 110.35 178.477 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 74.0 t80 -57.88 -63.14 1.35 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.875 -179.078 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -68.96 -29.27 67.46 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.914 -173.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 64.9 tttm -94.93 -17.22 22.19 Favored 'General case' 0 C--O 1.237 0.423 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -172.704 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 99.2 m-85 -133.29 -52.16 0.89 Allowed 'General case' 0 N--CA 1.468 0.442 0 N-CA-C 112.311 0.485 . . . . 0.0 112.311 -177.185 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 50.3 mm -67.03 -44.11 88.53 Favored 'Isoleucine or valine' 0 C--O 1.238 0.45 0 CA-C-O 120.886 0.374 . . . . 0.0 111.417 -172.048 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.465 ' HG3' ' H ' ' A' ' 74' ' ' ASP . 6.3 tp-100 -72.12 145.17 48.32 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.889 -174.624 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.422 ' O ' HG22 ' A' ' 73' ' ' THR . 13.2 m -85.78 27.45 0.86 Allowed 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 121.952 0.882 . . . . 0.0 110.36 178.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.465 ' H ' ' HG3' ' A' ' 72' ' ' GLN . 13.9 m-20 -128.83 20.96 5.94 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 174.018 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -86.33 159.38 53.49 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 114.988 -1.006 . . . . 0.0 111.837 -171.139 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_endo -85.65 11.63 3.29 Favored 'Trans proline' 0 C--N 1.35 0.634 0 C-N-CA 122.964 2.443 . . . . 0.0 111.973 177.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.661 ' HE2' ' HA ' ' A' ' 77' ' ' LYS . 0.4 OUTLIER -128.57 -44.41 1.37 Allowed 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.242 178.394 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 64.52 97.63 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.581 178.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 58.2 t -101.3 134.18 42.33 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.271 177.163 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 38.5 m-80 -83.48 27.32 0.61 Allowed 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.538 -176.182 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 9.4 tp -57.45 143.28 41.02 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.552 174.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -46.69 128.64 10.8 Favored 'General case' 0 C--O 1.237 0.446 0 O-C-N 123.892 0.745 . . . . 0.0 111.7 -175.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -59.22 -45.75 90.28 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.196 -175.046 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.478 ' O ' ' HB3' ' A' ' 87' ' ' GLU . 54.0 t60 -61.15 -29.63 69.9 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.898 179.662 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 28.2 m -71.34 -49.41 42.74 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.746 179.075 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.528 ' O ' HG23 ' A' ' 90' ' ' THR . 17.8 ptpt -66.95 -23.22 65.93 Favored 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 120.816 -0.353 . . . . 0.0 110.081 179.769 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.478 ' HB3' ' O ' ' A' ' 84' ' ' HIS . 41.1 tt0 -58.29 -53.09 62.19 Favored 'General case' 0 CA--C 1.532 0.253 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 171.196 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 58.5 t -58.88 -41.22 82.28 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.335 176.556 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 69.3 mt -60.41 -43.94 95.09 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.233 -179.515 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.528 HG23 ' O ' ' A' ' 86' ' ' LYS . 76.4 p -61.9 -31.68 72.0 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-O 121.214 0.53 . . . . 0.0 110.147 178.904 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . 0.484 HD22 ' N ' ' A' ' 91' ' ' ASN . 0.9 OUTLIER -79.95 -16.94 54.23 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.209 179.165 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 20.3 m -108.79 -14.24 14.63 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -176.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.0 tp -64.49 -21.61 29.51 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -170.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 7.7 t -57.01 -44.99 83.34 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 120.999 0.428 . . . . 0.0 110.368 177.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 -149.64 80.77 7.41 Favored Pre-proline 0 C--O 1.238 0.47 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 178.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.525 ' HG2' HG22 ' A' ' 59' ' ' ILE . 74.1 Cg_endo -75.42 -161.67 0.13 Allowed 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 123.058 2.505 . . . . 0.0 112.591 -176.368 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 9.4 m -152.49 165.73 34.18 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.671 -176.198 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -47.32 -60.72 2.31 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 122.644 0.378 . . . . 0.0 111.489 -177.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . 0.464 ' ND1' ' HD2' ' A' ' 51' ' ' LYS . 77.0 m-70 -95.32 24.54 4.98 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.548 -0.297 . . . . 0.0 111.51 -177.085 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 41.4 t -66.24 -40.15 90.05 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.268 0.556 . . . . 0.0 109.724 176.356 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 81.7 m-85 -88.02 6.91 33.75 Favored 'General case' 0 N--CA 1.463 0.187 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.911 179.1 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . 0.511 ' O ' ' HB3' ' A' ' 105' ' ' GLN . 9.5 t70 -70.54 -33.88 71.64 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 178.255 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.581 ' O ' ' HG2' ' A' ' 107' ' ' ARG . . . -61.99 -42.51 99.23 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.629 173.561 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.05 -41.03 86.9 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 115.808 -0.633 . . . . 0.0 110.064 176.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.511 ' HB3' ' O ' ' A' ' 102' ' ' ASP . 25.4 tt0 -53.24 -53.94 43.43 Favored 'General case' 0 C--O 1.224 -0.24 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.954 174.232 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 42.7 t -51.72 -44.98 63.41 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.253 -177.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . 0.581 ' HG2' ' O ' ' A' ' 103' ' ' ALA . 19.9 mmm180 -62.8 -50.72 69.88 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-O 120.937 0.398 . . . . 0.0 111.076 -175.49 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 90.7 t -71.52 -42.76 72.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.592 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.925 -177.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 59.8 t80 -58.12 -53.21 60.8 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.439 -0.8 . . . . 0.0 110.525 179.606 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.534 ' O ' ' HG2' ' A' ' 114' ' ' GLN . 0.0 OUTLIER -64.98 -32.05 73.59 Favored 'General case' 0 N--CA 1.461 0.091 0 N-CA-C 110.159 -0.312 . . . . 0.0 110.159 -178.994 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 58.2 tp -62.14 -62.32 1.86 Allowed 'General case' 0 N--CA 1.46 0.053 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.549 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . 0.471 ' O ' ' HB3' ' A' ' 116' ' ' SER . 25.4 ptt? -67.72 -21.55 65.29 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-O 120.747 0.308 . . . . 0.0 110.43 -178.443 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . 0.528 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 42.6 tt0 -64.22 -55.55 20.79 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 174.723 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . 0.534 ' HG2' ' O ' ' A' ' 110' ' ' GLN . 12.6 pt20 -77.5 -18.43 57.08 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.774 -177.046 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -114.96 3.9 14.64 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 -175.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . 0.471 ' HB3' ' O ' ' A' ' 112' ' ' MET . 32.2 t -147.03 -43.53 0.18 Allowed 'General case' 0 N--CA 1.466 0.339 0 O-C-N 122.068 -0.395 . . . . 0.0 111.442 177.726 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . 0.528 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 32.4 t80 -65.93 -40.3 91.29 Favored 'General case' 0 N--CA 1.47 0.569 0 CA-C-O 120.913 0.387 . . . . 0.0 110.579 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 29.9 p -56.73 -55.01 39.67 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-O 121.665 0.745 . . . . 0.0 110.035 174.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . 0.434 HH12 ' CD ' ' A' ' 35' ' ' GLU . 27.1 mtp180 -58.2 -35.34 71.49 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 114.881 -1.054 . . . . 0.0 110.863 176.558 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 79.4 t80 -60.71 -45.3 94.77 Favored 'General case' 0 C--O 1.224 -0.282 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 179.618 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 87.4 mt -63.67 -23.58 67.43 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.954 0.407 . . . . 0.0 110.471 177.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -101.43 0.77 37.44 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.17 -0.468 . . . . 0.0 112.255 179.054 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 76.6 p -76.58 147.08 37.89 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 120.627 0.251 . . . . 0.0 110.513 -176.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -58.21 -31.17 67.08 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 175.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 43.7 mm -56.69 -48.94 79.99 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 CA-C-N 115.144 -0.935 . . . . 0.0 110.631 175.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' TYR . . . . . 0.424 ' O ' ' HG2' ' A' ' 130' ' ' MET . 88.4 t80 -66.43 -43.66 85.04 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.572 -179.252 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -62.14 -34.12 75.76 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.408 178.114 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -64.36 -35.24 80.25 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.061 175.023 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 99.6 mt -76.53 -25.69 54.41 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.84 177.328 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' MET . . . . . 0.424 ' HG2' ' O ' ' A' ' 126' ' ' TYR . 12.7 mmt -71.07 -43.97 66.69 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.338 178.254 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 57.77 17.89 4.47 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.295 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . -88.3 6.65 83.3 Favored Glycine 0 CA--C 1.519 0.322 0 CA-C-N 116.186 -0.461 . . . . 0.0 113.262 -175.409 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 68.3 mtt-85 60.26 91.52 0.08 OUTLIER Pre-proline 0 CA--C 1.537 0.45 0 C-N-CA 122.77 0.428 . . . . 0.0 111.031 -179.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo . . . . . 0 C--N 1.348 0.534 0 C-N-CA 122.866 2.377 . . . . 0.0 113.01 -176.924 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 50.4 m . . . . . 0 N--CA 1.477 0.92 0 CA-C-O 120.519 0.199 . . . . 0.0 110.552 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 26.5 mmt -110.74 -170.11 1.58 Allowed 'General case' 0 C--O 1.236 0.351 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 177.369 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.516 HG21 ' CZ2' ' A' ' 11' ' ' TRP . 8.9 p -61.38 142.35 16.29 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 CA-C-O 120.926 0.393 . . . . 0.0 111.264 178.064 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.4 m -91.9 148.81 37.79 Favored Pre-proline 0 CA--C 1.534 0.362 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.059 177.067 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -50.38 -36.49 48.19 Favored 'Trans proline' 0 C--N 1.353 0.768 0 C-N-CA 123.078 2.518 . . . . 0.0 113.007 -176.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.566 ' O ' HG22 ' A' ' 9' ' ' VAL . 1.0 OUTLIER -65.65 -41.07 92.99 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 121.473 0.654 . . . . 0.0 110.029 179.844 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.521 ' O ' ' HB2' ' A' ' 10' ' ' LYS . 2.6 tm-20 -69.64 -30.27 67.93 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 178.283 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.83 -44.54 80.86 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.067 178.431 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.669 HG12 ' SD ' ' A' ' 130' ' ' MET . 17.5 m -66.3 -26.07 37.02 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.429 0 CA-C-O 120.942 0.401 . . . . 0.0 110.39 179.495 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.53 ' O ' ' HG2' ' A' ' 13' ' ' GLU . 41.5 mmtm -57.89 -34.56 69.93 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.984 175.038 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.516 ' CZ2' HG21 ' A' ' 3' ' ' VAL . 43.1 m0 -60.08 -32.43 70.95 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 120.871 0.367 . . . . 0.0 110.946 -179.142 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -65.19 -3.15 10.88 Favored Glycine 0 CA--C 1.521 0.448 0 CA-C-N 115.667 -0.697 . . . . 0.0 114.477 -171.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.53 ' HG2' ' O ' ' A' ' 10' ' ' LYS . 13.4 pt-20 -91.35 -32.52 15.65 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 117.68 0.74 . . . . 0.0 110.897 179.406 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 51.8 m -150.37 123.58 8.89 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.022 -174.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.479 ' HZ ' ' SD ' ' A' ' 112' ' ' MET . 17.9 t80 -58.92 -32.48 69.6 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.984 176.55 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -54.46 -43.73 71.94 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.904 175.253 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -67.59 -42.58 82.26 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.343 179.103 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 68.2 tp -54.44 -38.98 66.93 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.17 177.199 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 53.1 tp -75.11 -28.4 60.21 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.027 179.407 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 38.4 m -68.23 -36.18 79.1 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.258 -177.396 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -86.77 121.5 29.36 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 179.748 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 14.6 ptm180 -58.08 -28.21 64.36 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.118 0.485 . . . . 0.0 110.292 -179.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -61.75 -49.6 75.76 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.36 174.402 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -63.68 -44.67 96.04 Favored Glycine 0 C--N 1.335 0.492 0 CA-C-N 115.018 -0.992 . . . . 0.0 111.778 179.447 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 15.3 tp -48.7 -60.39 2.76 Favored 'General case' 0 C--O 1.233 0.196 0 C-N-CA 123.018 0.527 . . . . 0.0 111.072 177.314 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.478 ' O ' ' HB2' ' A' ' 30' ' ' ARG . 11.1 tp10 -59.01 -50.01 75.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.874 -175.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -60.68 -35.13 75.51 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-O 121.053 0.454 . . . . 0.0 111.106 -179.084 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 91.9 t80 -75.08 -46.3 35.59 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.861 -176.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.58 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 11.9 t -70.75 -27.8 64.22 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 -176.164 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.478 ' HB2' ' O ' ' A' ' 26' ' ' GLU . 0.2 OUTLIER -61.83 -54.73 38.14 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.191 -0.913 . . . . 0.0 109.863 177.714 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.49 ' O ' ' HB ' ' A' ' 34' ' ' THR . 86.9 t80 -57.62 -34.06 68.9 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.178 0.513 . . . . 0.0 110.653 -179.087 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 26.7 tp -74.81 -45.99 39.81 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.69 -0.687 . . . . 0.0 110.947 -178.242 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.58 ' HG3' ' O ' ' A' ' 29' ' ' THR . 68.3 mttm -60.95 -25.4 66.79 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.232 0.539 . . . . 0.0 110.002 177.211 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.49 ' HB ' ' O ' ' A' ' 31' ' ' PHE . 96.4 m -60.77 -35.31 76.09 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 115.466 -0.788 . . . . 0.0 111.263 177.691 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -101.89 9.78 40.34 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 120.986 0.422 . . . . 0.0 110.481 176.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 83.6 m-85 66.23 8.26 5.45 Favored 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 115.478 -0.783 . . . . 0.0 112.572 173.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 21.4 t -92.81 43.33 1.12 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.191 0.52 . . . . 0.0 109.751 -178.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -86.4 2.03 49.11 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.746 -174.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.35 -31.57 72.83 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -175.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.47 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 6.2 p30 -69.25 -57.99 4.63 Favored 'General case' 0 C--O 1.246 0.88 0 N-CA-C 111.969 0.359 . . . . 0.0 111.969 -176.38 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.517 ' HA ' ' HE1' ' A' ' 112' ' ' MET . 13.8 tt -63.0 -46.81 95.36 Favored 'Isoleucine or valine' 0 C--O 1.233 0.234 0 CA-C-O 120.574 0.226 . . . . 0.0 110.477 -177.184 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -62.99 -24.5 67.94 Favored 'General case' 0 CA--C 1.529 0.168 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.066 177.681 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.47 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 82.9 t80 -62.75 -63.2 1.28 Allowed 'General case' 0 C--O 1.235 0.312 0 C-N-CA 121.399 -0.121 . . . . 0.0 111.022 179.552 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.605 ' HE1' ' HE3' ' A' ' 112' ' ' MET . 20.9 p-90 -70.97 -19.86 62.5 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 119.439 -0.904 . . . . 0.0 111.468 -175.146 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.419 HG13 ' O ' ' A' ' 41' ' ' ILE . 66.3 mt -67.33 -51.05 56.84 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 CA-C-O 121.293 0.568 . . . . 0.0 109.786 170.846 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -62.39 -28.6 69.89 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.514 178.693 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.625 ' SG ' ' HB2' ' A' ' 101' ' ' PHE . 41.0 t -68.58 -33.43 74.05 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.583 -179.722 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.731 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 10.5 pt-20 -83.29 -25.69 31.33 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 120.444 -0.503 . . . . 0.0 110.318 176.661 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.465 ' HA ' ' HE3' ' A' ' 52' ' ' LYS . 18.1 t70 -62.57 -33.37 74.82 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 168.81 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 11.7 t80 -71.62 -56.12 6.45 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 114.632 -1.167 . . . . 0.0 111.121 174.599 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.731 ' HG2' ' HA ' ' A' ' 48' ' ' GLU . 25.4 pttm -85.03 11.49 9.47 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -171.4 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.465 ' HE3' ' HA ' ' A' ' 49' ' ' ASP . 18.5 ptpt -88.67 -24.19 22.82 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 168.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.4 ' HB2' ' HG2' ' A' ' 58' ' ' GLN . 17.3 p -90.25 122.03 32.81 Favored 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 174.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -100.13 6.16 44.89 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.623 -172.259 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . 0.448 ' O ' HG12 ' A' ' 59' ' ' ILE . . . -67.09 123.03 20.59 Favored Glycine 0 CA--C 1.519 0.309 0 C-N-CA 121.015 -0.612 . . . . 0.0 112.013 179.187 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.467 ' O ' ' HD2' ' A' ' 60' ' ' HIS . 12.2 Cg_endo -54.05 -46.91 30.12 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.671 2.248 . . . . 0.0 112.067 -177.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 82.0 mm-40 -64.29 -40.52 96.13 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-O 121.346 0.593 . . . . 0.0 109.845 178.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.462 ' OE1' HD11 ' A' ' 61' ' ' LEU . 6.5 tp-100 -58.66 -43.29 89.82 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 114.829 -1.078 . . . . 0.0 110.557 -179.116 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.448 HG12 ' O ' ' A' ' 55' ' ' GLY . 42.3 mm -57.29 -49.5 79.75 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.212 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.809 -178.055 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.467 ' HD2' ' O ' ' A' ' 56' ' ' PRO . 74.8 m-70 -64.45 -54.3 34.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.596 -0.275 . . . . 0.0 111.563 -173.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.516 HD12 ' N ' ' A' ' 62' ' ' LYS . 4.2 pp -64.48 -31.83 73.21 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.624 0.249 . . . . 0.0 111.648 -175.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.516 ' N ' HD12 ' A' ' 61' ' ' LEU . 36.3 mmtm -71.49 -53.16 14.82 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 120.629 0.252 . . . . 0.0 110.544 176.414 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.69 -38.08 74.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.885 -178.626 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 27.6 tptp -65.49 -41.26 93.46 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.232 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -64.84 -50.81 65.21 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.687 178.463 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 70.6 mt -58.58 -36.56 60.26 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.206 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.198 178.42 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.473 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 91.6 t80 -56.01 -63.65 1.11 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.674 178.327 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -64.4 -35.34 80.6 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.752 -0.658 . . . . 0.0 112.04 -174.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 80.9 tttt -90.32 -25.84 20.29 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -170.195 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -127.15 -48.36 1.46 Allowed 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -174.272 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.473 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 48.4 mm -70.56 -38.37 73.24 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 CA-C-O 120.947 0.403 . . . . 0.0 111.19 -173.396 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.503 ' HB3' ' HB2' ' A' ' 75' ' ' ALA . 6.2 tp-100 -61.04 141.37 57.44 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.106 -176.402 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 28.8 m -73.59 -35.06 65.36 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.237 0.541 . . . . 0.0 110.73 179.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -93.68 27.66 2.6 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 121.206 0.527 . . . . 0.0 110.501 175.098 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.503 ' HB2' ' HB3' ' A' ' 72' ' ' GLN . . . -70.93 160.64 81.67 Favored Pre-proline 0 C--O 1.235 0.341 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.49 176.489 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.481 ' HD2' ' HB1' ' A' ' 75' ' ' ALA . 12.2 Cg_endo -55.1 -35.03 89.58 Favored 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.799 2.332 . . . . 0.0 112.268 -179.097 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.427 ' O ' ' HB3' ' A' ' 78' ' ' GLU . 33.6 mtmm -122.95 -50.27 1.94 Allowed 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.826 176.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.427 ' HB3' ' O ' ' A' ' 77' ' ' LYS . 44.0 tt0 68.9 139.81 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.375 0 O-C-N 123.698 0.623 . . . . 0.0 110.803 -175.132 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.415 ' C ' ' H ' ' A' ' 81' ' ' LEU . 60.8 t -95.44 149.15 4.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-N 115.884 -0.598 . . . . 0.0 109.427 175.495 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 41.8 m-80 -70.68 17.24 0.07 Allowed 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 -177.642 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.575 HD11 HG21 ' A' ' 85' ' ' THR . 47.4 tp -60.97 144.07 53.96 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 122.746 0.418 . . . . 0.0 110.822 176.647 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -54.92 143.38 26.33 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.744 -177.054 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.448 ' HA ' ' HG2' ' A' ' 86' ' ' LYS . 89.9 t80 -62.23 -44.7 95.96 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.872 -178.673 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.416 ' O ' HG23 ' A' ' 88' ' ' VAL . 82.0 t60 -66.87 -30.31 70.44 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.567 0.222 . . . . 0.0 110.749 -178.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.575 HG21 HD11 ' A' ' 81' ' ' LEU . 27.1 m -69.29 -48.18 62.37 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 110.147 -0.316 . . . . 0.0 110.147 177.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.513 ' O ' HG23 ' A' ' 90' ' ' THR . 19.0 ptpt -65.97 -28.36 68.84 Favored 'General case' 0 N--CA 1.462 0.129 0 N-CA-C 109.754 -0.462 . . . . 0.0 109.754 178.011 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -60.18 -49.31 78.12 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.148 177.704 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.416 HG23 ' O ' ' A' ' 84' ' ' HIS . 58.3 t -56.4 -40.82 69.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-O 121.253 0.549 . . . . 0.0 109.678 176.209 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 72.3 mt -63.9 -42.62 96.41 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.968 178.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.513 HG23 ' O ' ' A' ' 86' ' ' LYS . 67.9 p -62.61 -25.35 68.05 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.891 0.377 . . . . 0.0 110.9 -178.126 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 57.4 m-80 -90.59 -23.74 20.76 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.252 178.615 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 31.1 t -98.22 -9.64 25.31 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.63 -176.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 9.4 tp -60.89 -26.14 37.81 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.515 0 N-CA-C 112.003 0.371 . . . . 0.0 112.003 -174.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 12.3 t -68.57 -24.41 64.6 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 120.83 0.348 . . . . 0.0 110.791 -179.191 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 -144.68 76.05 14.34 Favored Pre-proline 0 CA--C 1.532 0.268 0 CA-C-N 116.213 -0.448 . . . . 0.0 109.907 179.466 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -82.3 153.22 16.12 Favored 'Trans proline' 0 C--O 1.237 0.45 0 C-N-CA 122.671 2.247 . . . . 0.0 112.484 -178.118 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 47.8 p -111.3 174.09 6.03 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.228 176.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 34.7 tp -57.78 -57.27 13.49 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.371 0.605 . . . . 0.0 111.111 -178.297 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . 0.42 ' ND1' ' HB3' ' A' ' 102' ' ' ASP . 1.2 t-80 -95.85 12.65 29.42 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.326 -171.861 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 22.7 p -44.26 -47.42 9.4 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -172.312 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.625 ' HB2' ' SG ' ' A' ' 47' ' ' CYS . 99.0 m-85 -78.85 11.61 2.56 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.244 0.831 . . . . 0.0 113.244 -171.892 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . 0.455 ' HA ' ' HG2' ' A' ' 105' ' ' GLN . 8.6 p30 -60.47 -38.68 85.03 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 118.189 0.45 . . . . 0.0 111.545 -177.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.07 -38.76 83.84 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.191 0.519 . . . . 0.0 110.372 176.021 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -67.8 -36.16 79.92 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.801 -179.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.49 ' HG2' ' O ' ' A' ' 101' ' ' PHE . 13.0 mm-40 -56.87 -49.17 76.31 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-O 121.308 0.575 . . . . 0.0 109.569 179.822 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 45.2 t -59.12 -49.11 79.14 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.04 -0.982 . . . . 0.0 110.923 -179.024 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 28.1 mmm180 -59.46 -47.33 85.9 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.242 -177.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.432 HG21 ' CD2' ' A' ' 43' ' ' PHE . 88.6 t -66.61 -41.54 88.45 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.156 -178.623 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 65.1 t80 -64.86 -43.43 93.0 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.361 -177.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 5.3 pp0? -69.58 -37.25 76.87 Favored 'General case' 0 C--O 1.239 0.512 0 N-CA-C 111.535 0.198 . . . . 0.0 111.535 -175.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 4.5 pp -73.58 -24.84 60.13 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-O 120.836 0.35 . . . . 0.0 110.2 179.23 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . 0.605 ' HE3' ' HE1' ' A' ' 44' ' ' TRP . 34.4 ttm -66.38 -50.17 64.39 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.771 -0.65 . . . . 0.0 109.997 175.136 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . 0.573 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 38.2 tt0 -54.88 -57.86 9.91 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.081 -178.127 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 11.2 pt20 -60.88 -9.38 4.08 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 112.963 0.727 . . . . 0.0 112.963 -172.028 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . 0.456 ' O ' ' HG3' ' A' ' 119' ' ' ARG . 32.9 t70 -126.93 -68.85 0.78 Allowed 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 120.61 0.243 . . . . 0.0 111.087 178.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 22.7 t -60.96 -38.38 85.69 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 111.697 0.258 . . . . 0.0 111.697 -175.768 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . 0.573 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 42.0 t80 -71.52 -40.78 69.88 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 120.722 0.296 . . . . 0.0 110.706 -177.261 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 34.5 p -65.93 -43.73 87.23 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 109.905 -0.405 . . . . 0.0 109.905 177.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . 0.456 ' HG3' ' O ' ' A' ' 115' ' ' ASP . 90.2 mtt180 -55.66 -44.1 76.91 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 115.965 -0.562 . . . . 0.0 110.135 174.213 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 80.3 t80 -58.95 -41.98 88.76 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.299 179.188 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 83.6 mt -70.88 -14.86 62.54 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.811 0.338 . . . . 0.0 111.113 179.134 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . 0.623 ' HA ' ' HE3' ' A' ' 122' ' ' LYS . 0.0 OUTLIER -113.88 7.48 17.0 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.601 179.326 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 97.0 p -84.42 148.95 26.31 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 120.624 0.25 . . . . 0.0 111.041 -179.412 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -60.15 -29.92 68.97 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 174.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 42.0 mm -55.12 -57.09 8.06 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-N 115.261 -0.881 . . . . 0.0 111.167 178.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' TYR . . . . . 0.463 ' O ' ' HG2' ' A' ' 130' ' ' MET . 31.7 t80 -66.22 -38.75 88.69 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.909 0.385 . . . . 0.0 110.324 -178.236 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 92.1 mt -65.27 -28.57 69.43 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.599 178.512 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -71.9 -37.56 70.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.001 178.194 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 81.0 mt -64.6 -31.84 73.23 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.964 176.352 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' MET . . . . . 0.669 ' SD ' HG12 ' A' ' 9' ' ' VAL . 26.2 mmt -70.15 -52.88 20.04 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.769 176.846 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 60.56 23.22 12.94 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 115.241 -0.89 . . . . 0.0 110.762 -179.06 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . -69.75 -21.38 76.48 Favored Glycine 0 C--N 1.33 0.249 0 C-N-CA 120.972 -0.632 . . . . 0.0 111.991 179.415 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 8.2 ttp180 -171.67 106.21 0.37 Allowed Pre-proline 0 C--N 1.33 -0.282 0 C-N-CA 122.754 0.421 . . . . 0.0 109.91 179.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo . . . . . 0 C--N 1.349 0.598 0 C-N-CA 122.838 2.359 . . . . 0.0 112.039 179.136 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.498 ' HB3' ' HB3' ' A' ' 23' ' ' ASP . 44.0 m . . . . . 0 N--CA 1.476 0.843 0 CA-C-O 121.225 0.536 . . . . 0.0 110.456 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 49.5 ttm -136.74 123.36 21.02 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.711 178.014 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.475 HG12 HD22 ' A' ' 129' ' ' LEU . 14.7 p -77.79 152.86 5.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.901 -174.045 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 29.5 m -95.58 149.24 35.82 Favored Pre-proline 0 CA--C 1.535 0.372 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.434 173.155 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -44.21 -46.39 11.47 Favored 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 123.623 2.882 . . . . 0.0 113.793 -173.056 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.641 ' O ' HG22 ' A' ' 9' ' ' VAL . 33.9 tt0 -61.78 -47.7 83.96 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 120.696 0.284 . . . . 0.0 111.178 -175.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -64.35 -34.96 79.35 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.109 0.48 . . . . 0.0 109.889 178.235 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.61 -38.29 89.64 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.235 -179.605 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.641 HG22 ' O ' ' A' ' 6' ' ' GLU . 11.4 m -75.15 -25.89 18.55 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 C-N-CA 120.92 -0.312 . . . . 0.0 110.63 179.833 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.554 ' HG2' ' O ' ' A' ' 6' ' ' GLU . 74.8 mmtt -60.35 -34.48 73.9 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.008 0.432 . . . . 0.0 110.268 176.86 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.416 ' CE3' HD13 ' A' ' 18' ' ' LEU . 49.1 m0 -61.72 -22.37 65.31 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.802 179.451 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -64.61 -13.03 54.73 Favored Glycine 0 CA--C 1.519 0.31 0 CA-C-N 115.848 -0.614 . . . . 0.0 113.072 -178.098 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.527 ' HG2' ' O ' ' A' ' 10' ' ' LYS . 10.7 pt-20 -79.89 -23.19 42.01 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 117.029 0.415 . . . . 0.0 110.739 179.78 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 31.6 t -171.0 132.01 0.83 Allowed 'General case' 0 C--O 1.238 0.469 0 CA-C-O 121.377 0.608 . . . . 0.0 111.716 -177.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 28.6 t80 -60.86 -29.04 69.29 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.255 -0.884 . . . . 0.0 109.861 174.385 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -55.85 -43.79 77.39 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.508 175.555 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 33.3 ttmt -66.96 -40.49 87.5 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.479 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.416 HD13 ' CE3' ' A' ' 11' ' ' TRP . 39.1 tp -59.23 -40.5 86.1 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.149 0.499 . . . . 0.0 110.311 175.514 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 39.6 tp -73.86 -36.67 64.86 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.341 -176.429 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 24.6 p -79.56 -23.26 42.92 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.583 -177.017 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -74.71 114.45 13.15 Favored 'General case' 0 C--O 1.223 -0.304 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 177.193 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.514 ' HD2' ' H ' ' A' ' 22' ' ' ARG . 4.2 mpt_? -56.18 -42.32 76.89 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-O 120.902 0.382 . . . . 0.0 111.167 -170.709 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.498 ' HB3' ' HB3' ' A' ' 1' ' ' SER . 4.1 p-10 -70.18 -33.05 71.27 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.693 176.365 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -64.72 -54.19 30.13 Favored Glycine 0 C--N 1.332 0.357 0 N-CA-C 111.397 -0.681 . . . . 0.0 111.397 177.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.9 tt -54.63 -40.0 68.53 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 123.085 0.554 . . . . 0.0 110.308 174.736 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -60.87 -42.83 98.68 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-O 121.059 0.456 . . . . 0.0 110.305 177.73 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -68.87 -36.88 78.62 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.202 0.525 . . . . 0.0 110.516 178.158 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 77.3 t80 -70.32 -43.22 70.75 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.712 -175.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.584 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 7.2 t -64.85 -44.04 91.05 Favored 'General case' 0 C--N 1.333 -0.137 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 178.658 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 87.7 mtm180 -57.85 -27.76 63.51 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-O 121.047 0.451 . . . . 0.0 110.651 178.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.522 ' O ' HG22 ' A' ' 34' ' ' THR . 75.9 t80 -83.32 -41.17 18.55 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.779 175.036 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 17.5 tp -76.62 -21.26 55.77 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.744 -171.483 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.584 ' HG3' ' O ' ' A' ' 29' ' ' THR . 68.5 mttm -61.68 -30.51 70.78 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.343 -178.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.522 HG22 ' O ' ' A' ' 31' ' ' PHE . 9.6 t -65.37 -31.0 71.89 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.077 -175.601 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -102.3 8.05 40.46 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 120.916 0.388 . . . . 0.0 110.79 179.41 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 88.9 m-85 59.79 20.05 8.87 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 115.62 -0.718 . . . . 0.0 111.897 174.435 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 33.0 t -85.59 1.06 50.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 121.197 0.522 . . . . 0.0 110.348 -177.429 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 52.1 tt0 -58.91 -30.85 68.12 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.283 -179.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -60.74 -24.16 65.49 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.136 179.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.522 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 93.6 m-20 -68.21 -39.96 82.25 Favored 'General case' 0 C--O 1.238 0.459 0 CA-C-O 121.405 0.621 . . . . 0.0 109.424 174.689 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.4 ' O ' HG13 ' A' ' 45' ' ' ILE . 46.0 mt -63.47 -49.73 81.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.422 173.88 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.444 ' HA ' ' HB ' ' A' ' 45' ' ' ILE . 49.9 mt-10 -60.85 -27.21 67.93 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.891 178.273 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.522 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 62.5 t80 -58.67 -62.61 1.73 Allowed 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.302 176.694 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.526 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 16.0 p-90 -74.91 -14.61 60.67 Favored 'General case' 0 CA--C 1.528 0.1 0 C-N-CA 119.66 -0.816 . . . . 0.0 111.442 -177.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.444 ' HB ' ' HA ' ' A' ' 42' ' ' GLU . 15.6 mt -61.9 -47.11 94.74 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 167.797 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.83 -30.15 70.27 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.275 177.074 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.419 ' HB3' ' HA ' ' A' ' 44' ' ' TRP . 25.6 t -62.71 -46.28 88.84 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.455 175.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.526 ' HG2' ' O ' ' A' ' 44' ' ' TRP . 26.7 mm-40 -64.35 -35.09 79.75 Favored 'General case' 0 C--N 1.333 -0.134 0 N-CA-C 110.133 -0.321 . . . . 0.0 110.133 178.534 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.421 ' HA ' ' HE2' ' A' ' 52' ' ' LYS . 1.3 m-20 -57.61 -47.54 81.88 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 173.234 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.418 ' CZ ' HG23 ' A' ' 59' ' ' ILE . 57.8 t80 -59.73 -39.05 83.43 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.457 177.04 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.441 ' HG2' ' HA ' ' A' ' 99' ' ' HIS . 53.3 mtpt -72.82 -26.61 61.56 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.807 -177.819 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.459 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 65.1 pttt -105.04 -1.89 25.09 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 111.614 0.227 . . . . 0.0 111.614 -178.329 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 35.6 p -79.37 135.48 36.72 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 110.308 -0.256 . . . . 0.0 110.308 177.531 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.68 154.75 20.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.975 0.417 . . . . 0.0 110.499 -179.828 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 99.58 110.83 3.17 Favored Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 111.115 -0.794 . . . . 0.0 111.115 -176.31 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -51.55 -38.88 65.58 Favored 'Trans proline' 0 C--N 1.352 0.736 0 C-N-CA 122.9 2.4 . . . . 0.0 111.851 -177.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 -54.54 -49.89 69.23 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.119 178.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 8.5 tp-100 -58.16 -43.49 87.43 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.15 -0.932 . . . . 0.0 110.016 -179.502 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.418 HG23 ' CZ ' ' A' ' 50' ' ' PHE . 46.7 mm -60.88 -46.82 95.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.4 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.505 -178.79 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.447 ' O ' ' HG2' ' A' ' 64' ' ' LYS . 12.3 m170 -62.7 -48.14 80.57 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.358 -174.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.587 HD12 ' N ' ' A' ' 62' ' ' LYS . 3.6 pp -72.48 -38.05 68.28 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.47 -176.644 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.587 ' N ' HD12 ' A' ' 61' ' ' LEU . 28.7 mmtp -64.76 -38.68 91.79 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-O 120.786 0.327 . . . . 0.0 110.566 177.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.04 -47.61 77.55 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.499 177.014 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.447 ' HG2' ' O ' ' A' ' 60' ' ' HIS . 48.3 mmtm -62.62 -40.79 98.06 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.898 -179.429 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.83 -55.61 28.06 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.355 -178.404 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 68.0 mt -60.99 -35.99 69.09 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 CA-C-O 121.296 0.57 . . . . 0.0 110.244 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.528 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 79.7 t80 -59.2 -67.99 0.32 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.152 -179.432 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -61.51 -31.52 71.52 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.254 -0.43 . . . . 0.0 112.013 -173.558 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.42 ' HE3' ' CE2' ' A' ' 70' ' ' PHE . 36.4 ttpt -83.03 -32.26 26.98 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 112.225 0.454 . . . . 0.0 112.225 -172.699 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.42 ' CE2' ' HE3' ' A' ' 69' ' ' LYS . 51.2 m-85 -131.98 -46.87 0.94 Allowed 'General case' 0 N--CA 1.468 0.448 0 N-CA-C 112.894 0.702 . . . . 0.0 112.894 -174.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.528 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 47.7 mm -68.95 -37.14 76.9 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 CA-C-O 120.749 0.309 . . . . 0.0 111.581 -173.215 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.761 ' HG3' ' H ' ' A' ' 74' ' ' ASP . 6.4 tp-100 -57.98 138.29 56.03 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.868 -176.513 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 15.3 m -79.92 9.3 5.5 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.747 0.784 . . . . 0.0 110.708 -179.202 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.761 ' H ' ' HG3' ' A' ' 72' ' ' GLN . 22.0 m-20 -132.9 25.23 4.3 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.245 -0.888 . . . . 0.0 108.744 172.204 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -70.78 156.02 92.57 Favored Pre-proline 0 CA--C 1.531 0.225 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.031 -178.2 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -62.17 -23.93 75.87 Favored 'Trans proline' 0 C--N 1.35 0.619 0 C-N-CA 122.702 2.268 . . . . 0.0 112.762 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 30.9 mmtp -115.57 -56.84 2.3 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.312 179.167 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 65.8 114.77 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.372 0 O-C-N 123.671 0.607 . . . . 0.0 110.983 -173.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.441 ' O ' HG12 ' A' ' 79' ' ' VAL . 10.6 t -91.88 25.6 0.39 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 CA-C-O 121.118 0.485 . . . . 0.0 110.101 179.187 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 9.5 p30 43.01 27.97 0.12 Allowed 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.821 0.848 . . . . 0.0 112.388 179.277 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.481 HD11 HG21 ' A' ' 85' ' ' THR . 24.5 tp -56.79 145.45 29.3 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.635 -0.712 . . . . 0.0 111.94 -178.47 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -48.03 138.9 8.63 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 115.135 -0.939 . . . . 0.0 111.808 179.467 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.545 ' HA ' ' HD2' ' A' ' 86' ' ' LYS . 64.5 t80 -64.22 -41.52 96.98 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 115.877 -0.602 . . . . 0.0 111.826 -174.714 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 85.1 t60 -70.19 -29.5 66.38 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.863 0.363 . . . . 0.0 110.46 -178.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.481 HG21 HD11 ' A' ' 81' ' ' LEU . 25.9 m -69.17 -41.12 77.64 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 175.06 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.545 ' HD2' ' HA ' ' A' ' 83' ' ' PHE . 47.4 mttm -54.77 -46.77 74.45 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.801 -0.636 . . . . 0.0 109.504 171.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -52.19 -55.38 21.47 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 114.938 -1.028 . . . . 0.0 110.966 -179.001 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 61.9 t -55.06 -43.19 68.69 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 CA-C-O 121.176 0.513 . . . . 0.0 110.601 -179.317 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 74.3 mt -66.63 -41.63 88.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.949 -178.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 68.7 p -66.86 -18.89 65.6 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-O 121.0 0.428 . . . . 0.0 110.955 -179.241 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 79.8 m-20 -86.97 -31.6 20.53 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.046 -179.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 22.3 p -107.17 -4.61 18.63 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -175.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 8.0 tp -54.3 -28.11 17.89 Favored 'Isoleucine or valine' 0 C--O 1.238 0.493 0 N-CA-C 112.003 0.372 . . . . 0.0 112.003 -174.707 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.497 HG23 ' HG2' ' A' ' 95' ' ' GLN . 3.4 t -55.1 -48.84 73.03 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.752 177.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.497 ' HG2' HG23 ' A' ' 94' ' ' THR . 21.8 pt20 -162.19 82.02 1.76 Allowed Pre-proline 0 CA--C 1.532 0.261 0 CA-C-O 121.282 0.563 . . . . 0.0 109.871 -177.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -85.26 167.23 10.68 Favored 'Trans proline' 0 CA--C 1.531 0.374 0 C-N-CA 123.012 2.475 . . . . 0.0 113.227 -174.332 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.441 HG22 ' H ' ' A' ' 98' ' ' LEU . 2.9 m -86.34 169.43 12.95 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.109 179.535 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.441 ' H ' HG22 ' A' ' 97' ' ' THR . 3.6 mm? -50.49 -49.41 55.51 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 122.883 0.473 . . . . 0.0 111.852 -176.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . 0.441 ' HA ' ' HG2' ' A' ' 51' ' ' LYS . 19.1 m-70 -100.82 33.02 2.93 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 120.86 0.362 . . . . 0.0 111.322 -175.813 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 25.2 p -64.74 -50.27 67.55 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.946 0.403 . . . . 0.0 110.946 179.053 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -78.59 6.15 9.37 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.528 -179.531 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -58.61 -36.67 74.41 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.163 0.506 . . . . 0.0 110.231 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.9 -44.35 91.21 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.454 174.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.58 -39.3 90.68 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.464 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.515 ' HG2' ' HB2' ' A' ' 44' ' ' TRP . 0.9 OUTLIER -57.48 -52.1 66.76 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 115.958 -0.564 . . . . 0.0 109.751 176.185 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 25.2 t -61.44 -38.3 86.7 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.847 -178.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . 0.571 ' O ' ' HG ' ' A' ' 111' ' ' LEU . 36.7 mmt180 -65.51 -57.1 9.06 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.441 -179.334 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.456 ' HA ' HD12 ' A' ' 111' ' ' LEU . 93.3 t -59.95 -40.58 83.38 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-O 120.892 0.377 . . . . 0.0 110.858 -177.856 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . 0.51 ' HA ' ' HE1' ' A' ' 112' ' ' MET . 3.6 t80 -56.0 -49.61 73.16 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 115.751 -0.659 . . . . 0.0 111.198 177.591 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.526 ' HG2' ' O ' ' A' ' 107' ' ' ARG . 10.5 pt20 -72.51 -17.73 61.72 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.653 -0.249 . . . . 0.0 111.015 -176.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.571 ' HG ' ' O ' ' A' ' 107' ' ' ARG . 73.3 mt -68.39 -58.65 4.04 Favored 'General case' 0 C--O 1.235 0.312 0 O-C-N 123.189 0.305 . . . . 0.0 110.853 178.609 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . 0.51 ' HE1' ' HA ' ' A' ' 109' ' ' TYR . 0.1 OUTLIER -75.92 -14.41 60.26 Favored 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 120.132 -0.627 . . . . 0.0 110.342 -179.002 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . 0.598 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 39.3 tt0 -60.91 -61.35 2.64 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.145 0.498 . . . . 0.0 109.761 172.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -69.51 5.15 1.47 Allowed 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.816 -0.629 . . . . 0.0 112.595 -173.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -129.4 -66.27 0.82 Allowed 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 120.897 0.379 . . . . 0.0 111.302 176.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 7.4 m -72.64 -28.12 62.55 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.951 -172.276 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . 0.598 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 34.1 t80 -64.89 -46.97 79.51 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 121.219 -0.192 . . . . 0.0 110.691 -179.081 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 31.7 p -64.13 -43.34 95.58 Favored 'General case' 0 C--O 1.239 0.531 0 CA-C-O 121.131 0.491 . . . . 0.0 110.294 179.327 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 51.8 mtt180 -57.33 -42.85 82.71 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.124 175.283 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.423 ' O ' ' HB2' ' A' ' 126' ' ' TYR . 78.4 t80 -61.53 -42.7 99.21 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.385 179.369 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 90.1 mt -60.04 -32.76 71.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.587 -0.279 . . . . 0.0 111.612 -178.359 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . 0.726 ' HA ' ' HE2' ' A' ' 122' ' ' LYS . 10.0 mmpt? -110.73 11.49 22.62 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 111.998 0.37 . . . . 0.0 111.998 -179.331 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 79.4 p -74.48 156.55 36.8 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-O 120.797 0.332 . . . . 0.0 110.718 177.745 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -55.63 -30.29 60.71 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.152 175.319 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.478 ' N ' HD12 ' A' ' 125' ' ' ILE . 2.3 mp -63.09 -49.77 82.06 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.142 0 CA-C-N 115.406 -0.816 . . . . 0.0 110.218 -178.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' TYR . . . . . 0.423 ' HB2' ' O ' ' A' ' 120' ' ' PHE . 71.0 t80 -65.63 -35.41 80.72 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.777 -177.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 88.7 mt -66.36 -34.84 78.88 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.914 0.388 . . . . 0.0 109.956 176.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -68.86 -33.26 73.51 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.844 -0.616 . . . . 0.0 109.79 175.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.475 HD22 HG12 ' A' ' 3' ' ' VAL . 88.6 mt -74.04 -32.66 63.43 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.386 176.104 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' MET . . . . . 0.431 ' HA ' ' CE ' ' A' ' 130' ' ' MET . 7.5 mmt -57.0 -55.76 30.47 Favored 'General case' 0 CA--C 1.519 -0.246 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.687 176.5 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 69.36 -65.23 0.31 Allowed 'General case' 0 N--CA 1.465 0.325 0 O-C-N 124.08 0.862 . . . . 0.0 111.434 176.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . -72.5 -44.79 39.85 Favored Glycine 0 N--CA 1.45 -0.403 0 CA-C-N 115.996 -0.547 . . . . 0.0 113.127 -172.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . 0.494 ' O ' ' HG3' ' A' ' 133' ' ' ARG . 34.0 ptt180 -113.77 98.31 47.03 Favored Pre-proline 0 CA--C 1.538 0.486 0 CA-C-O 121.201 0.524 . . . . 0.0 111.389 -177.182 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo . . . . . 0 N--CA 1.459 -0.523 0 C-N-CA 122.753 2.302 . . . . 0.0 110.936 171.703 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 37.4 t . . . . . 0 N--CA 1.48 1.037 0 N-CA-C 110.225 -0.287 . . . . 0.0 110.225 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 53.3 ttm 57.18 84.95 0.09 Allowed 'General case' 0 C--O 1.236 0.354 0 O-C-N 123.664 0.603 . . . . 0.0 111.132 178.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 2.6 p -66.96 132.07 32.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.459 176.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.6 m -61.74 141.66 94.99 Favored Pre-proline 0 CA--C 1.534 0.339 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.248 178.585 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -55.22 -35.39 90.99 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 122.564 2.176 . . . . 0.0 111.845 -179.65 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -65.48 -49.36 69.37 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 178.009 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -55.65 -44.32 77.09 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.112 176.524 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.34 -57.03 14.81 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.255 -178.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 26.5 m -64.03 -26.06 39.6 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 CA-C-O 120.826 0.346 . . . . 0.0 110.682 -179.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 16.3 tppt? -68.86 -30.16 68.62 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.499 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.453 ' HZ2' ' ND1' ' A' ' 21' ' ' HIS . 54.5 m0 -62.1 -31.52 71.98 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 121.058 0.456 . . . . 0.0 109.926 174.529 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -59.79 -16.44 38.54 Favored Glycine 0 C--N 1.335 0.508 0 CA-C-N 115.787 -0.642 . . . . 0.0 113.518 -175.056 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -116.77 3.86 12.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.624 0.249 . . . . 0.0 110.987 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 43.9 m -152.02 98.01 2.39 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 120.871 0.367 . . . . 0.0 111.136 -178.3 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 57.1 t80 -65.2 -36.0 82.82 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 121.313 0.578 . . . . 0.0 109.554 178.157 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -58.93 -32.84 69.93 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.278 -0.873 . . . . 0.0 110.325 177.347 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 22.9 ttmm -72.98 -39.17 66.31 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.0 -0.545 . . . . 0.0 109.86 -179.61 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.497 HD22 ' CE1' ' A' ' 117' ' ' TYR . 14.9 tp -56.18 -50.48 71.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.983 174.499 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 34.4 tp -70.55 -31.57 68.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.133 -0.939 . . . . 0.0 111.524 -175.22 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 38.6 p -81.4 -25.77 35.97 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 120.693 0.282 . . . . 0.0 111.113 -179.697 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.453 ' ND1' ' HZ2' ' A' ' 11' ' ' TRP . 23.8 t-80 -85.29 118.0 24.57 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 179.492 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 39.5 mtm180 -42.24 -54.88 3.52 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 123.08 0.552 . . . . 0.0 111.751 -177.193 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -57.14 -36.36 70.61 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.265 -179.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -71.98 -51.31 14.97 Favored Glycine 0 N--CA 1.451 -0.302 0 N-CA-C 111.674 -0.57 . . . . 0.0 111.674 -178.468 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 7.0 tt -54.03 -48.16 70.79 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.247 -0.476 . . . . 0.0 110.277 176.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -61.31 -51.23 69.73 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.632 -179.315 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -60.58 -41.62 95.01 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.326 -177.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 77.6 t80 -74.9 -42.17 58.33 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.178 -175.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.443 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 10.6 t -64.66 -43.5 93.42 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 120.966 -0.293 . . . . 0.0 110.418 -176.771 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.46 -33.04 74.32 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 121.073 0.463 . . . . 0.0 110.006 179.315 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.468 ' O ' HG22 ' A' ' 34' ' ' THR . 92.4 t80 -65.95 -48.99 69.51 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.499 178.686 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 19.5 tp -68.77 -26.16 65.08 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.102 0.477 . . . . 0.0 110.882 -175.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.543 ' HG2' ' HB3' ' A' ' 38' ' ' GLU . 68.4 mttm -85.26 -1.17 56.65 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.611 -179.419 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.468 HG22 ' O ' ' A' ' 31' ' ' PHE . 3.8 t -69.79 -33.34 72.25 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 120.937 0.398 . . . . 0.0 110.339 179.755 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -118.79 16.73 13.54 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.356 178.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 83.5 m-85 60.15 28.89 18.5 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 115.418 -0.81 . . . . 0.0 112.009 176.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 21.8 t -82.27 4.71 22.57 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 121.884 0.849 . . . . 0.0 108.779 174.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.543 ' HB3' ' HG2' ' A' ' 33' ' ' LYS . 13.7 pt-20 -56.42 -19.31 14.38 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 114.577 -1.192 . . . . 0.0 111.629 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.44 ' O ' ' HB2' ' A' ' 43' ' ' PHE . 10.1 mm-40 -45.77 -33.07 2.84 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.083 179.384 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.517 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 49.7 m-80 -72.63 -47.49 47.23 Favored 'General case' 0 C--O 1.24 0.581 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.552 -178.434 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.513 ' HA ' ' HE1' ' A' ' 112' ' ' MET . 13.6 tt -70.94 -45.41 73.15 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 -177.257 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.474 ' OE1' ' HB2' ' A' ' 38' ' ' GLU . 4.2 mp0 -63.26 -23.27 67.35 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.65 174.318 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.517 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 66.8 t80 -62.09 -60.85 3.0 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 120.471 0.176 . . . . 0.0 110.776 177.632 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.656 ' HB2' ' HG3' ' A' ' 105' ' ' GLN . 13.1 p-90 -72.92 -9.68 58.97 Favored 'General case' 0 C--O 1.233 0.235 0 C-N-CA 119.258 -0.977 . . . . 0.0 111.513 -177.58 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.409 HG13 ' O ' ' A' ' 41' ' ' ILE . 79.8 mt -79.82 -33.22 14.64 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 166.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.47 ' HA ' ' OD2' ' A' ' 49' ' ' ASP . . . -67.14 -21.62 65.81 Favored 'General case' 0 CA--C 1.522 -0.105 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.64 179.071 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 44.4 t -68.72 -32.82 72.89 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.731 172.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.529 ' O ' ' HG2' ' A' ' 51' ' ' LYS . 17.0 mm-40 -75.17 -49.25 20.06 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.316 179.646 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.51 ' HA ' ' HD3' ' A' ' 52' ' ' LYS . 3.1 p30 -70.32 -11.99 61.28 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 120.342 -0.543 . . . . 0.0 110.465 177.426 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 24.5 t80 -71.76 -49.2 41.09 Favored 'General case' 0 C--N 1.333 -0.141 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.371 174.201 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.529 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 13.1 ptmm? -62.38 -26.08 68.27 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.891 0.376 . . . . 0.0 109.998 176.855 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.51 ' HD3' ' HA ' ' A' ' 49' ' ' ASP . 51.1 mtpt -67.34 -31.44 71.7 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.674 175.22 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 31.6 m -82.32 51.26 1.77 Allowed 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 121.243 0.544 . . . . 0.0 109.81 178.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.77 16.83 0.08 Allowed 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 114.052 1.131 . . . . 0.0 114.052 -170.186 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . 0.491 ' O ' HG12 ' A' ' 59' ' ' ILE . . . -65.88 130.64 33.5 Favored Glycine 0 CA--C 1.523 0.569 0 C-N-CA 120.555 -0.831 . . . . 0.0 111.211 175.504 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -50.46 -43.93 42.09 Favored 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 123.058 2.505 . . . . 0.0 113.009 -173.664 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 22.0 tm0? -93.83 -33.15 13.66 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 179.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 25.5 tp60 -54.11 -35.6 62.33 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.958 179.391 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.491 HG12 ' O ' ' A' ' 55' ' ' GLY . 27.1 mm -52.77 -42.25 41.5 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.611 176.201 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 22.8 m-70 -65.63 -45.18 84.04 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.52 -177.466 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 91.0 mt -68.03 -43.65 78.28 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.011 -178.504 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.48 ' NZ ' HD11 ' A' ' 66' ' ' ILE . 8.0 tmtt? -66.35 -40.96 90.13 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.768 -0.651 . . . . 0.0 109.512 -177.105 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.9 -41.3 87.39 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.543 176.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 14.6 tppt? -53.69 -46.99 70.88 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.723 177.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.7 -59.68 4.66 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.579 179.235 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.48 HD11 ' NZ ' ' A' ' 62' ' ' LYS . 66.5 mt -56.73 -35.59 46.28 Favored 'Isoleucine or valine' 0 C--O 1.235 0.336 0 CA-C-O 121.37 0.605 . . . . 0.0 110.522 179.545 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.431 ' OH ' HG22 ' A' ' 90' ' ' THR . 83.1 t80 -62.8 -67.68 0.4 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.171 -176.803 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.505 ' HA ' ' HB2' ' A' ' 72' ' ' GLN . 29.1 mt-10 -77.43 -1.81 32.1 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 112.067 0.395 . . . . 0.0 112.067 -172.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 65.8 tttp -100.57 -28.73 12.73 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 116.865 -0.152 . . . . 0.0 111.334 177.486 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.438 ' HB3' HG23 ' A' ' 79' ' ' VAL . 75.0 m-85 -132.86 -43.98 0.88 Allowed 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -175.657 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 45.5 mm -77.0 -36.59 25.2 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 CA-C-O 120.698 0.285 . . . . 0.0 111.691 -173.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.505 ' HB2' ' HA ' ' A' ' 68' ' ' GLU . 60.0 tp60 -59.25 133.66 56.3 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.829 -175.194 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 37.1 p -61.95 124.06 19.74 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.017 177.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 26.9 t70 70.99 29.9 2.88 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.593 -0.73 . . . . 0.0 111.117 -178.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.442 ' HB1' ' HD2' ' A' ' 76' ' ' PRO . . . -63.65 164.91 13.71 Favored Pre-proline 0 CA--C 1.537 0.445 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.724 171.682 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.442 ' HD2' ' HB1' ' A' ' 75' ' ' ALA . 84.7 Cg_exo -45.18 -57.61 2.02 Favored 'Trans proline' 0 C--N 1.356 0.955 0 C-N-CA 122.499 2.133 . . . . 0.0 111.915 178.834 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.1 72.66 1.47 Allowed 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 171.736 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -68.05 146.76 53.2 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.184 -178.289 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.479 HG11 HG22 ' A' ' 108' ' ' VAL . 53.5 t -85.02 147.05 5.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 176.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 46.7 m-80 -77.86 51.8 0.98 Allowed 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 121.606 0.717 . . . . 0.0 110.151 177.723 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.407 HD11 HG21 ' A' ' 85' ' ' THR . 44.8 tp -73.79 147.22 43.62 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.001 -0.999 . . . . 0.0 110.351 178.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -50.34 139.98 14.24 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.431 178.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 47.8 p90 -64.79 -37.35 87.33 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.945 -176.26 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.421 ' O ' ' HB3' ' A' ' 87' ' ' GLU . 72.4 t60 -69.16 -36.61 77.59 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 120.81 0.338 . . . . 0.0 110.379 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.407 HG21 HD11 ' A' ' 81' ' ' LEU . 38.7 m -66.86 -43.99 82.14 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.374 -0.376 . . . . 0.0 110.121 176.831 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.446 ' O ' HG23 ' A' ' 90' ' ' THR . 95.7 mttt -60.82 -38.56 85.85 Favored 'General case' 0 N--CA 1.464 0.235 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 174.831 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.421 ' HB3' ' O ' ' A' ' 84' ' ' HIS . 43.2 tt0 -56.52 -50.19 72.56 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.41 177.719 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.413 HG23 ' O ' ' A' ' 84' ' ' HIS . 96.2 t -62.42 -51.15 75.85 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.797 179.079 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 71.4 mt -57.73 -49.29 81.29 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.221 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.273 -176.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.446 HG23 ' O ' ' A' ' 86' ' ' LYS . 49.1 p -57.66 -39.98 78.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.166 0.507 . . . . 0.0 111.083 -178.473 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 32.9 m-80 -85.61 -4.87 59.28 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.983 -176.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 15.3 m -124.88 0.84 8.04 Favored 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -179.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.7 tp -66.63 -23.01 30.6 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 CA-C-O 120.761 0.315 . . . . 0.0 111.459 -174.006 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.554 HG23 ' HG2' ' A' ' 95' ' ' GLN . 15.4 t -63.03 -25.31 68.32 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.981 179.298 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.554 ' HG2' HG23 ' A' ' 94' ' ' THR . 11.4 pt20 -151.83 77.25 7.11 Favored Pre-proline 0 CA--C 1.536 0.412 0 CA-C-O 121.236 0.541 . . . . 0.0 110.503 179.596 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.475 ' HG2' HG22 ' A' ' 59' ' ' ILE . 96.4 Cg_endo -88.69 159.31 6.32 Favored 'Trans proline' 0 N--CA 1.461 -0.418 0 C-N-CA 122.768 2.312 . . . . 0.0 112.214 179.134 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.485 ' H ' ' HB2' ' A' ' 100' ' ' SER . 18.5 p -96.3 172.28 8.05 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.938 176.355 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 10.4 mp -53.29 -30.32 38.07 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 112.887 0.699 . . . . 0.0 112.887 -174.029 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 1.4 t-80 -133.2 31.71 3.79 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.907 0.384 . . . . 0.0 110.513 -176.458 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . 0.485 ' HB2' ' H ' ' A' ' 97' ' ' THR . 23.5 t -54.68 -26.02 30.8 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.82 -177.321 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -83.68 17.9 2.11 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.438 -178.703 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -56.94 -50.13 73.53 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.917 0.389 . . . . 0.0 110.965 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.7 -47.97 83.53 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.671 179.074 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.404 ' O ' HG23 ' A' ' 108' ' ' VAL . . . -60.52 -36.81 79.29 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.532 178.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.656 ' HG3' ' HB2' ' A' ' 44' ' ' TRP . 57.3 tt0 -57.29 -44.16 83.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.185 -179.246 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 14.4 m -69.36 -41.72 76.2 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.762 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . 0.483 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 38.4 mmt180 -60.03 -43.94 94.98 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.365 -178.119 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.479 HG22 HG11 ' A' ' 79' ' ' VAL . 83.4 t -69.22 -43.4 81.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-O 120.95 0.405 . . . . 0.0 111.068 -177.655 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 25.0 t80 -56.8 -46.22 81.73 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.376 179.293 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.483 ' HG3' ' O ' ' A' ' 107' ' ' ARG . 5.3 pp0? -70.11 -36.46 74.86 Favored 'General case' 0 C--O 1.238 0.485 0 N-CA-C 111.677 0.251 . . . . 0.0 111.677 -175.819 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.484 ' HA ' ' HG2' ' A' ' 114' ' ' GLN . 4.5 pp -74.0 -28.05 61.26 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 120.815 -0.354 . . . . 0.0 110.269 179.415 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . 0.513 ' HE1' ' HA ' ' A' ' 41' ' ' ILE . 44.2 ttm -61.89 -39.63 92.61 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.563 175.162 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . 0.455 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 3.2 tm-20 -59.79 -60.88 3.13 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.624 -0.717 . . . . 0.0 110.164 177.56 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . 0.484 ' HG2' ' HA ' ' A' ' 111' ' ' LEU . 13.7 pt20 -64.63 -18.13 64.65 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 112.584 0.587 . . . . 0.0 112.584 -173.072 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -110.28 -67.27 1.0 Allowed 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.138 0.494 . . . . 0.0 111.71 -179.542 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 17.4 m -72.5 -31.45 65.37 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.696 -172.589 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . 0.497 ' CE1' HD22 ' A' ' 18' ' ' LEU . 18.3 t80 -81.72 -36.91 28.09 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.175 -0.61 . . . . 0.0 110.924 -177.602 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 22.0 p -60.04 -47.49 85.65 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-O 120.905 0.384 . . . . 0.0 110.45 178.353 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 14.7 ptp180 -61.49 -36.07 79.44 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 176.025 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -65.56 -33.84 76.85 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.557 177.343 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 86.3 mt -65.15 -28.69 69.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.028 0.442 . . . . 0.0 110.196 176.736 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 3.7 tppp? -93.44 -9.86 37.08 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.379 179.157 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 60.7 p -59.85 146.84 40.52 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-O 121.153 0.501 . . . . 0.0 111.578 -176.301 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -59.73 -38.03 80.56 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.173 179.31 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.456 ' O ' ' HG ' ' A' ' 129' ' ' LEU . 0.0 OUTLIER -64.49 -47.04 90.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.66 -176.922 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 72.0 t80 -66.38 -48.35 70.4 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 120.877 0.37 . . . . 0.0 111.132 -177.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 95.5 mt -63.37 -29.59 70.87 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.871 -179.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -67.79 -39.23 84.04 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.668 177.079 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 125' ' ' ILE . 97.8 mt -61.15 -47.86 84.24 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.988 -179.103 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' MET . . . . . 0.411 ' HG3' ' N ' ' A' ' 131' ' ' GLU . 14.8 ptp -76.06 -41.02 51.97 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.249 -178.846 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . 0.411 ' N ' ' HG3' ' A' ' 130' ' ' MET . 38.8 tt0 62.77 -72.21 0.05 OUTLIER 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 123.375 0.67 . . . . 0.0 110.747 -175.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 168.4 -52.94 0.22 Allowed Glycine 0 N--CA 1.449 -0.49 0 N-CA-C 110.899 -0.88 . . . . 0.0 110.899 -178.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -171.85 100.9 0.38 Allowed Pre-proline 0 CA--C 1.535 0.398 0 C-N-CA 122.756 0.423 . . . . 0.0 110.849 177.48 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo . . . . . 0 C--N 1.348 0.542 0 C-N-CA 123.222 2.614 . . . . 0.0 112.43 177.581 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 23.9 t . . . . . 0 N--CA 1.479 0.983 0 CA-C-O 120.804 0.335 . . . . 0.0 110.557 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 23.8 ptm -103.65 118.21 36.2 Favored 'General case' 0 C--O 1.234 0.257 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 175.826 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 6.8 p -165.49 151.64 2.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-O 120.89 0.376 . . . . 0.0 111.56 -176.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 17.3 m -100.17 148.19 34.54 Favored Pre-proline 0 CA--C 1.535 0.383 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.743 175.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_exo -49.27 -44.22 34.68 Favored 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 123.057 2.505 . . . . 0.0 113.232 -177.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.439 ' HA ' HG22 ' A' ' 9' ' ' VAL . 32.6 mt-10 -70.61 -24.38 62.73 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.222 -177.175 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.404 ' O ' ' HB3' ' A' ' 10' ' ' LYS . 21.2 tp10 -73.21 -34.33 65.88 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 173.187 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.745 ' HB3' ' SD ' ' A' ' 130' ' ' MET . . . -66.68 -42.22 86.85 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.048 179.789 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.439 HG22 ' HA ' ' A' ' 6' ' ' GLU . 27.1 m -68.26 -25.69 32.2 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 CA-C-O 120.971 0.415 . . . . 0.0 110.195 175.594 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.404 ' HB3' ' O ' ' A' ' 7' ' ' GLU . 16.9 tppt? -69.58 -27.86 65.48 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.007 174.074 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 46.8 m0 -72.15 -35.27 69.02 Favored 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 109.243 -0.651 . . . . 0.0 109.243 171.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -69.0 -2.64 32.03 Favored Glycine 0 N--CA 1.452 -0.298 0 CA-C-N 115.15 -0.932 . . . . 0.0 113.568 -176.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -115.42 4.44 14.33 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 117.048 0.424 . . . . 0.0 110.507 176.778 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.1 p -161.46 92.95 0.91 Allowed 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 121.039 0.447 . . . . 0.0 111.101 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.413 ' CE1' HD23 ' A' ' 18' ' ' LEU . 13.1 t80 -58.27 -38.6 77.28 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.007 177.851 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -48.88 -42.07 35.47 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.312 -0.858 . . . . 0.0 110.389 173.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -76.12 -27.37 57.05 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.26 -178.473 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.413 HD23 ' CE1' ' A' ' 15' ' ' PHE . 52.8 tp -59.15 -43.27 92.04 Favored 'General case' 0 N--CA 1.463 0.218 0 N-CA-C 110.054 -0.35 . . . . 0.0 110.054 179.008 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -75.31 -32.02 60.84 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.374 176.547 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 43.3 t -61.72 -35.3 77.64 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.476 178.093 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -80.56 115.08 19.89 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 177.195 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.31 -44.3 54.05 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 121.254 0.549 . . . . 0.0 110.583 177.084 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -72.39 -28.23 62.86 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.827 -178.507 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -71.01 -44.83 54.2 Favored Glycine 0 N--CA 1.451 -0.324 0 N-CA-C 111.063 -0.815 . . . . 0.0 111.063 177.084 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.3 tt -62.57 -41.46 98.95 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 114.923 -0.639 . . . . 0.0 110.481 177.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.498 ' O ' ' HG2' ' A' ' 30' ' ' ARG . 43.6 tt0 -58.84 -47.84 83.43 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.876 0.37 . . . . 0.0 110.211 177.473 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -63.61 -40.86 98.0 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.963 0.411 . . . . 0.0 110.78 179.241 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 73.2 t80 -64.53 -45.4 87.36 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.071 -177.202 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.531 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 9.7 t -66.54 -41.67 88.35 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 120.91 -0.316 . . . . 0.0 110.558 -179.451 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.498 ' HG2' ' O ' ' A' ' 26' ' ' GLU . 12.1 mmt180 -54.1 -36.01 62.76 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 120.994 0.426 . . . . 0.0 110.395 178.651 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.454 ' O ' HG22 ' A' ' 34' ' ' THR . 63.4 t80 -70.62 -53.73 14.76 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.566 -0.743 . . . . 0.0 110.543 175.579 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 28.2 tp -64.07 -24.1 67.58 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.91 -173.181 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.531 ' HG3' ' O ' ' A' ' 29' ' ' THR . 68.5 mttm -65.02 -14.05 59.43 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 116.749 -0.205 . . . . 0.0 111.336 179.58 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.454 HG22 ' O ' ' A' ' 31' ' ' PHE . 14.3 t -62.82 -34.51 77.46 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 120.851 0.358 . . . . 0.0 110.7 179.275 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -115.76 7.94 14.75 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.13 -175.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 92.5 m-85 59.54 17.09 5.79 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 115.942 -0.572 . . . . 0.0 112.542 173.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 8.4 t -86.86 27.57 0.99 Allowed 'General case' 0 C--O 1.235 0.3 0 CA-C-O 121.63 0.729 . . . . 0.0 109.638 -179.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 64.6 tt0 -71.83 -13.62 61.73 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.292 -0.867 . . . . 0.0 110.956 -177.177 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.469 ' HB3' ' HB3' ' A' ' 77' ' ' LYS . 0.8 OUTLIER -55.74 -26.61 46.39 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 111.704 0.261 . . . . 0.0 111.704 -178.354 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.411 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 57.3 m-80 -61.65 -50.15 73.68 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-O 121.625 0.726 . . . . 0.0 109.944 173.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 61.7 mt -63.5 -49.72 81.42 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.935 178.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -57.96 -30.87 66.35 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.805 177.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.411 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 79.1 t80 -58.69 -63.23 1.36 Allowed 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.502 179.733 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.581 ' HA ' ' SG ' ' A' ' 47' ' ' CYS . 6.2 p-90 -79.05 -5.99 55.34 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 119.545 -0.862 . . . . 0.0 112.148 -178.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 8.8 mt -69.37 -45.88 77.91 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 166.335 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.45 -32.04 73.49 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 115.627 -0.715 . . . . 0.0 110.326 177.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.581 ' SG ' ' HA ' ' A' ' 44' ' ' TRP . 73.6 m -64.35 -30.72 71.76 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.801 177.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.463 ' HG3' ' HE3' ' A' ' 51' ' ' LYS . 39.8 tt0 -77.0 -40.86 45.14 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 178.011 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -61.44 -31.64 71.59 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 121.525 0.679 . . . . 0.0 109.671 173.531 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.462 ' CZ ' HG23 ' A' ' 59' ' ' ILE . 56.4 t80 -65.36 -52.67 52.12 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 114.911 -1.04 . . . . 0.0 111.162 178.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.463 ' HE3' ' HG3' ' A' ' 48' ' ' GLU . 0.0 OUTLIER -68.87 -21.49 64.26 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-O 121.347 0.594 . . . . 0.0 110.028 179.749 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 8.8 tttm -69.68 -19.71 63.58 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.271 173.363 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 15.5 m -84.29 43.66 0.97 Allowed 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.517 179.041 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.19 98.47 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.678 0.752 . . . . 0.0 112.407 -177.477 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . 0.515 ' O ' HG12 ' A' ' 59' ' ' ILE . . . -179.91 129.15 1.3 Allowed Glycine 0 C--O 1.226 -0.392 0 N-CA-C 110.624 -0.99 . . . . 0.0 110.624 176.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_endo -46.29 -58.23 1.79 Allowed 'Trans proline' 0 C--N 1.348 0.53 0 C-N-CA 122.951 2.434 . . . . 0.0 112.997 -172.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -71.16 -38.15 72.19 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 120.978 0.418 . . . . 0.0 110.543 -178.566 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.585 ' OE1' HD11 ' A' ' 61' ' ' LEU . 5.4 tp-100 -57.46 -42.31 82.32 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.489 -178.357 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.515 HG12 ' O ' ' A' ' 55' ' ' GLY . 36.9 mm -58.46 -47.12 89.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.706 -0.679 . . . . 0.0 111.312 -178.69 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 16.6 m-70 -64.76 -46.04 83.84 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.277 -174.499 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.585 HD11 ' OE1' ' A' ' 58' ' ' GLN . 4.5 pp -71.59 -33.23 68.86 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.127 -176.928 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.476 ' N ' HD12 ' A' ' 61' ' ' LEU . 12.3 mmmm -68.55 -42.67 78.05 Favored 'General case' 0 N--CA 1.465 0.289 0 N-CA-C 110.095 -0.335 . . . . 0.0 110.095 176.061 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.22 -39.48 90.41 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.372 177.305 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.478 ' O ' ' HB3' ' A' ' 67' ' ' TYR . 4.0 tmtp? -65.3 -38.22 89.53 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.71 -0.677 . . . . 0.0 109.898 179.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -65.36 -49.85 67.78 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 121.137 0.494 . . . . 0.0 110.303 177.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 70.8 mt -61.66 -30.65 48.74 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.069 177.128 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.542 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 78.2 t80 -58.85 -58.32 9.14 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.494 178.334 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -70.09 -26.65 64.08 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.88 -0.6 . . . . 0.0 112.095 -172.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 35.2 ttpt -99.87 -28.31 13.18 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 -174.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -120.27 -45.27 2.45 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -176.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.542 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 44.2 mm -76.64 -22.6 15.12 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 CA-C-O 120.573 0.225 . . . . 0.0 110.984 -173.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.502 ' HG3' ' H ' ' A' ' 74' ' ' ASP . 6.3 tp60 -50.54 148.18 4.02 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.735 176.601 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 26.1 m -57.48 -42.85 83.47 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.267 -179.629 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.502 ' H ' ' HG3' ' A' ' 72' ' ' GLN . 6.7 m-20 -82.88 -72.4 0.45 Allowed 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.281 -179.44 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . 69.24 134.71 0.04 OUTLIER Pre-proline 0 CA--C 1.535 0.403 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.761 -177.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -59.33 -35.76 96.05 Favored 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 122.587 2.191 . . . . 0.0 112.044 -178.39 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.469 ' HB3' ' HB3' ' A' ' 39' ' ' GLU . 14.1 mmmm -87.88 -15.61 36.24 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.575 178.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 58.73 83.14 0.13 Allowed 'General case' 0 C--O 1.236 0.387 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.018 -177.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.447 HG12 ' H ' ' A' ' 81' ' ' LEU . 35.9 t -80.93 140.74 16.18 Favored 'Isoleucine or valine' 0 C--O 1.234 0.275 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.48 -176.679 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 23.9 m-80 -88.54 11.26 17.7 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.118 -0.492 . . . . 0.0 112.025 -172.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.49 HD11 HG21 ' A' ' 85' ' ' THR . 25.7 tp -59.15 145.0 44.09 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 112.244 0.461 . . . . 0.0 112.244 -175.336 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.455 ' O ' ' HG3' ' A' ' 86' ' ' LYS . 10.9 t70 -55.64 145.33 23.92 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 115.044 -0.98 . . . . 0.0 112.543 -177.76 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 45.7 p90 -67.3 -42.46 83.69 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.812 -175.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.492 ' O ' ' HB3' ' A' ' 87' ' ' GLU . 69.4 t60 -69.15 -29.51 67.56 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.898 0.38 . . . . 0.0 110.341 -177.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.536 ' OG1' ' HG3' ' A' ' 107' ' ' ARG . 22.1 m -67.15 -45.97 75.48 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 176.589 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.455 ' HG3' ' O ' ' A' ' 82' ' ' ASP . 26.3 mtpp -56.65 -39.08 73.08 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 109.26 -0.645 . . . . 0.0 109.26 175.24 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.492 ' HB3' ' O ' ' A' ' 84' ' ' HIS . 56.1 tt0 -58.18 -53.83 53.89 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.601 177.639 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 84' ' ' HIS . 96.9 t -55.14 -43.2 69.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-O 121.071 0.462 . . . . 0.0 110.312 179.446 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.405 HG13 ' O ' ' A' ' 85' ' ' THR . 73.9 mt -65.25 -42.43 93.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.091 -179.394 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 41.1 p -64.38 -18.39 64.63 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 120.93 0.395 . . . . 0.0 111.031 -179.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 47.6 m-80 -88.85 -41.56 12.4 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.564 174.472 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 22.8 t -87.83 0.54 55.66 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.572 -174.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 8.9 tp -57.12 -29.1 31.04 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.383 0 CA-C-O 120.945 0.402 . . . . 0.0 111.143 -179.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 9.0 t -68.27 -33.88 75.17 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.826 179.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 75.5 mm-40 -139.25 80.32 23.49 Favored Pre-proline 0 C--O 1.234 0.276 0 CA-C-O 120.988 0.423 . . . . 0.0 110.955 -178.067 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.498 ' HG2' HG22 ' A' ' 59' ' ' ILE . 89.5 Cg_endo -85.72 133.63 4.42 Favored 'Trans proline' 0 N--CA 1.46 -0.461 0 C-N-CA 122.685 2.257 . . . . 0.0 111.774 174.36 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.435 ' N ' ' HB2' ' A' ' 100' ' ' SER . 9.5 p -83.22 176.2 9.35 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.71 176.676 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.439 ' H ' HD22 ' A' ' 98' ' ' LEU . 3.4 mm? -52.14 -45.98 65.2 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.042 0.448 . . . . 0.0 111.229 -175.108 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 7.7 t-80 -116.78 31.85 6.5 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.754 -176.58 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . 0.435 ' HB2' ' N ' ' A' ' 97' ' ' THR . 20.8 t -45.87 -40.09 9.51 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 115.633 -0.712 . . . . 0.0 112.683 -172.797 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 -76.04 16.5 0.42 Allowed 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 112.001 0.371 . . . . 0.0 112.001 -177.131 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -58.47 -46.99 85.48 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 121.08 0.466 . . . . 0.0 110.786 178.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.409 ' O ' ' HG2' ' A' ' 107' ' ' ARG . . . -58.78 -42.89 90.06 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.403 178.568 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.0 -36.71 85.28 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.649 179.54 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -57.56 -51.44 69.48 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.419 177.327 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . 0.659 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 31.4 t -57.3 -48.55 78.64 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.211 179.655 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . 0.536 ' HG3' ' OG1' ' A' ' 85' ' ' THR . 24.9 mmt180 -53.42 -54.85 30.93 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.317 -179.337 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.527 ' HA ' HD12 ' A' ' 111' ' ' LEU . 98.7 t -60.16 -40.21 82.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.563 -179.604 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . 0.599 ' HA ' ' SD ' ' A' ' 112' ' ' MET . 28.5 t80 -57.25 -41.21 79.18 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.147 178.718 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.659 ' HG3' ' O ' ' A' ' 106' ' ' SER . 48.9 mt-30 -63.46 -39.94 95.81 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 121.55 0.69 . . . . 0.0 109.816 178.659 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.535 ' HG ' ' O ' ' A' ' 107' ' ' ARG . 93.9 mt -59.33 -49.11 79.09 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 114.581 -1.191 . . . . 0.0 111.934 -173.16 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . 0.599 ' SD ' ' HA ' ' A' ' 109' ' ' TYR . 0.0 OUTLIER -91.07 -5.62 54.95 Favored 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 120.364 -0.534 . . . . 0.0 110.956 -179.188 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . 0.632 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 42.3 tt0 -69.97 -66.43 0.59 Allowed 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 174.496 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 28.3 pt20 -51.85 -31.73 29.06 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.579 -177.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -98.65 -72.15 0.66 Allowed 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.653 -177.003 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 14.4 m -71.27 -31.46 67.52 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 -168.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . 0.632 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 15.7 t80 -64.48 -57.34 9.5 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 117.829 0.286 . . . . 0.0 110.633 -178.55 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 39.5 p -60.09 -46.65 88.88 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 121.372 0.606 . . . . 0.0 110.327 179.1 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 20.5 ttp85 -61.0 -31.3 70.91 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.831 178.633 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 86.0 t80 -70.87 -39.73 72.71 Favored 'General case' 0 C--O 1.225 -0.218 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 177.09 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 87.9 mt -62.34 -22.53 66.15 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.932 0.396 . . . . 0.0 110.403 178.023 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -101.44 -11.98 18.93 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.998 177.299 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 82.7 p -65.44 144.59 56.96 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 120.662 0.268 . . . . 0.0 111.013 -175.322 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -57.62 -31.14 65.95 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.214 177.076 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 2.3 mp -52.71 -53.18 21.99 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 CA-C-O 121.298 0.57 . . . . 0.0 110.254 175.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -61.91 -48.3 81.09 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.597 -178.114 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.477 ' HA ' ' HB2' ' A' ' 130' ' ' MET . 3.9 mm? -68.05 -20.35 64.97 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.106 -179.507 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -76.92 -26.27 53.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.065 0.46 . . . . 0.0 110.192 177.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 70.8 mt -82.49 -34.86 27.85 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 107.268 -1.382 . . . . 0.0 107.268 175.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' MET . . . . . 0.745 ' SD ' ' HB3' ' A' ' 8' ' ' ALA . 83.2 mmm -82.67 -165.24 1.0 Allowed 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 113.272 -1.785 . . . . 0.0 110.656 178.66 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -162.34 -34.09 0.04 OUTLIER 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 114.723 -1.126 . . . . 0.0 109.805 -177.578 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 124.7 55.78 0.18 Allowed Glycine 0 N--CA 1.45 -0.382 0 CA-C-N 116.138 -0.483 . . . . 0.0 112.575 175.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . 0.465 ' NE ' ' HA ' ' A' ' 133' ' ' ARG . 1.4 tpm_? -128.58 83.24 66.76 Favored Pre-proline 0 CA--C 1.531 0.25 0 CA-C-N 116.983 0.392 . . . . 0.0 110.776 175.708 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo . . . . . 0 N--CA 1.459 -0.51 0 C-N-CA 123.099 2.533 . . . . 0.0 111.727 175.291 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 49.0 m . . . . . 0 N--CA 1.477 0.908 0 CA-C-O 120.706 0.289 . . . . 0.0 110.698 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 45.3 ttp -135.98 20.19 3.25 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.597 0.713 . . . . 0.0 109.639 -179.373 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.474 HG23 ' HB3' ' A' ' 7' ' ' GLU . 1.5 p -62.56 120.5 9.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 115.178 -0.919 . . . . 0.0 111.349 177.141 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 45.1 t -80.73 154.46 73.39 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.536 175.538 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_endo -48.12 -36.64 29.0 Favored 'Trans proline' 0 C--N 1.353 0.773 0 C-N-CA 122.701 2.268 . . . . 0.0 112.108 176.188 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.501 ' O ' ' HG2' ' A' ' 10' ' ' LYS . 33.5 mt-10 -70.28 -32.36 70.13 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 121.282 0.563 . . . . 0.0 110.543 178.421 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.474 ' HB3' HG23 ' A' ' 3' ' ' VAL . 18.9 tp10 -71.99 -32.63 67.4 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 176.583 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.94 -46.53 84.3 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.855 178.553 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.458 HG22 ' O ' ' A' ' 6' ' ' GLU . 19.8 m -66.45 -26.65 38.17 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.23 0 C-N-CA 121.054 -0.258 . . . . 0.0 110.491 179.026 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.501 ' HG2' ' O ' ' A' ' 6' ' ' GLU . 74.2 mmtt -62.81 -44.32 96.46 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.952 0.406 . . . . 0.0 110.016 172.334 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 39.0 m0 -64.49 -27.61 69.1 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.27 0.557 . . . . 0.0 109.863 176.615 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -76.99 -14.51 82.56 Favored Glycine 0 N--CA 1.449 -0.499 0 CA-C-N 115.326 -0.852 . . . . 0.0 112.647 178.47 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 56.7 mt-10 -69.84 -50.83 38.88 Favored 'General case' 0 CA--C 1.521 -0.173 0 CA-C-O 121.203 0.525 . . . . 0.0 110.279 178.129 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 28.6 m -152.45 134.07 14.61 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.602 -175.073 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.43 ' CE1' HD23 ' A' ' 18' ' ' LEU . 1.7 t80 -60.29 -35.06 74.71 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.478 -178.205 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -65.03 -32.98 74.97 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.489 -0.323 . . . . 0.0 110.459 179.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 4.3 ttmp? -65.95 -38.46 88.64 Favored 'General case' 0 N--CA 1.464 0.253 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 177.146 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.43 HD23 ' CE1' ' A' ' 15' ' ' PHE . 56.5 tp -58.22 -46.81 85.2 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 115.729 -0.669 . . . . 0.0 109.947 174.677 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.418 ' HG ' ' HH2' ' A' ' 44' ' ' TRP . 6.7 mp -62.77 -37.56 87.14 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.191 177.631 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 52.4 m -73.06 -11.7 60.65 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.341 -177.531 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -98.26 114.18 26.37 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 179.549 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 10.7 mmt85 -50.27 -48.53 54.78 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.091 0.472 . . . . 0.0 111.129 177.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -69.25 -19.25 63.93 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.511 -179.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -80.47 -44.67 8.47 Favored Glycine 0 C--N 1.334 0.436 0 CA-C-N 115.7 -0.682 . . . . 0.0 111.594 178.536 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.41 HD11 HD12 ' A' ' 45' ' ' ILE . 7.1 tp -50.51 -51.66 45.49 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.542 0.686 . . . . 0.0 109.913 173.2 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.431 ' O ' ' HG3' ' A' ' 30' ' ' ARG . 9.0 tp10 -58.93 -52.99 63.36 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.603 -1.18 . . . . 0.0 110.703 -178.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -58.38 -39.54 79.9 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.993 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 79.7 t80 -67.11 -49.26 65.55 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.801 -178.487 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.501 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 14.6 t -66.2 -36.68 83.7 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 110.363 -0.236 . . . . 0.0 110.363 -177.254 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.431 ' HG3' ' O ' ' A' ' 26' ' ' GLU . 62.9 mtp180 -57.52 -41.9 81.75 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 120.888 0.375 . . . . 0.0 110.513 176.889 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.568 ' O ' HG22 ' A' ' 34' ' ' THR . 51.3 t80 -72.64 -43.79 62.74 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.453 176.621 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.489 HD21 ' OD1' ' A' ' 40' ' ' ASN . 19.4 tp -62.08 -28.56 69.7 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.184 -174.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.573 ' HG2' ' HB3' ' A' ' 38' ' ' GLU . 99.2 mttt -79.78 -4.87 53.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.534 -179.583 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.568 HG22 ' O ' ' A' ' 31' ' ' PHE . 1.0 OUTLIER -84.62 -17.74 37.7 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 176.039 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -113.44 0.73 14.83 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.747 177.566 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 48.0 t80 68.28 16.79 9.33 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.804 174.708 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 31.7 m -85.28 9.17 16.03 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 121.099 0.476 . . . . 0.0 110.327 177.099 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.573 ' HB3' ' HG2' ' A' ' 33' ' ' LYS . 10.0 pt-20 -56.31 -19.31 13.76 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 115.429 -0.805 . . . . 0.0 112.454 -177.515 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -50.04 -37.92 35.46 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.341 -179.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.536 ' ND2' ' HB3' ' A' ' 112' ' ' MET . 28.6 p30 -81.23 -39.04 25.98 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-N 115.934 -0.576 . . . . 0.0 112.224 -172.272 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.454 HG22 ' O ' ' A' ' 38' ' ' GLU . 9.8 tp -65.8 -43.64 93.26 Favored 'Isoleucine or valine' 0 C--O 1.234 0.254 0 N-CA-C 109.727 -0.472 . . . . 0.0 109.727 -179.419 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.41 ' HA ' HG22 ' A' ' 45' ' ' ILE . 0.6 OUTLIER -66.32 -31.8 72.81 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.735 176.359 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.424 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 81.7 t80 -55.11 -70.19 0.11 Allowed 'General case' 0 C--O 1.238 0.491 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.558 179.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.418 ' HH2' ' HG ' ' A' ' 19' ' ' LEU . 28.4 p-90 -81.72 -15.82 53.15 Favored 'General case' 0 C--N 1.332 -0.181 0 C-N-CA 119.854 -0.738 . . . . 0.0 112.67 -171.418 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.41 HG22 ' HA ' ' A' ' 42' ' ' GLU . 10.8 tt -67.13 -35.76 75.15 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 173.451 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.49 -36.64 83.24 Favored 'General case' 0 N--CA 1.456 -0.128 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.574 173.546 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 72.8 m -66.32 -24.62 66.56 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.075 176.678 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.528 ' HA ' ' HB2' ' A' ' 51' ' ' LYS . 12.6 mm-40 -83.37 -22.87 32.67 Favored 'General case' 0 C--O 1.233 0.218 0 O-C-N 122.272 -0.268 . . . . 0.0 110.556 175.644 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.426 ' HA ' ' HG2' ' A' ' 52' ' ' LYS . 24.5 t70 -68.06 -42.56 80.28 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 168.327 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.423 ' CE1' HG23 ' A' ' 59' ' ' ILE . 6.3 t80 -57.02 -32.87 66.61 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 114.711 -1.132 . . . . 0.0 110.197 170.282 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.528 ' HB2' ' HA ' ' A' ' 48' ' ' GLU . 0.0 OUTLIER -73.45 -40.42 64.19 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.297 -176.905 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.426 ' HG2' ' HA ' ' A' ' 49' ' ' ASP . 7.0 ptmm? -74.78 -26.63 59.88 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 120.579 0.228 . . . . 0.0 111.154 179.667 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 28.8 p -77.84 67.34 3.69 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-O 121.174 0.512 . . . . 0.0 109.691 175.412 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.491 ' HB2' ' NZ ' ' A' ' 54' ' ' LYS . 0.0 OUTLIER -77.08 16.96 0.49 Allowed 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.387 -0.824 . . . . 0.0 113.162 -170.937 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -68.94 133.78 27.06 Favored Glycine 0 CA--C 1.52 0.398 0 C-N-CA 120.451 -0.881 . . . . 0.0 110.937 176.052 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -54.21 -42.1 70.25 Favored 'Trans proline' 0 C--N 1.347 0.463 0 C-N-CA 122.729 2.286 . . . . 0.0 112.642 -174.177 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -89.07 -29.1 19.67 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.17 0.51 . . . . 0.0 109.908 179.005 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.489 ' OE1' HD11 ' A' ' 61' ' ' LEU . 4.7 tp-100 -56.23 -42.25 76.99 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.268 -0.878 . . . . 0.0 109.714 178.296 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.423 HG23 ' CE1' ' A' ' 50' ' ' PHE . 29.9 mm -54.58 -39.6 46.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.308 178.295 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 19.9 m-70 -66.02 -52.06 52.67 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.185 -175.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.489 HD11 ' OE1' ' A' ' 58' ' ' GLN . 4.6 pp -69.74 -32.21 70.62 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.964 -177.459 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.489 ' N ' HD12 ' A' ' 61' ' ' LEU . 66.6 mmtt -66.69 -43.65 83.83 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 121.174 0.512 . . . . 0.0 109.997 174.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.22 -47.54 85.55 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.952 -179.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 3.5 tppp? -63.66 -35.37 80.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.502 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.83 -53.27 59.9 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.048 0.451 . . . . 0.0 110.401 177.661 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 65.5 mt -62.9 -37.62 79.71 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.392 178.154 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.549 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 71.9 t80 -57.21 -56.87 16.22 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.735 -179.487 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.458 ' HA ' ' HG2' ' A' ' 72' ' ' GLN . 42.8 mt-10 -70.69 -30.09 66.57 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.529 -175.203 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 58.2 tttm -90.9 -19.04 23.78 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.723 -173.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 99.4 m-85 -136.35 -53.2 0.73 Allowed 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -176.052 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.549 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 45.7 mm -73.1 -24.09 20.58 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 -167.433 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.458 ' HG2' ' HA ' ' A' ' 68' ' ' GLU . 13.5 mm-40 -53.67 139.88 30.91 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 120.851 0.358 . . . . 0.0 111.244 179.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 65.2 m -71.97 69.68 0.73 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.609 0.719 . . . . 0.0 110.089 176.25 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 21.2 t70 170.59 -76.69 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 107.406 -1.331 . . . . 0.0 107.406 -178.274 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.406 ' HA ' ' HD3' ' A' ' 76' ' ' PRO . . . 59.95 149.07 0.08 OUTLIER Pre-proline 0 CA--C 1.538 0.493 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 169.622 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 75' ' ' ALA . 21.3 Cg_exo -67.43 -20.07 48.5 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 122.508 2.139 . . . . 0.0 111.625 173.815 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.757 ' HE2' ' HA ' ' A' ' 77' ' ' LYS . 11.2 mmpt? -105.25 -19.7 13.73 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.149 -179.379 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 52.19 77.98 0.14 Allowed 'General case' 0 CA--C 1.536 0.424 0 CA-C-O 121.317 0.58 . . . . 0.0 110.082 -175.704 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 59.0 t -84.94 117.52 30.35 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.95 -175.605 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -80.23 77.39 6.97 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.35 0.595 . . . . 0.0 110.35 179.261 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 20.5 tp -110.75 148.06 33.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.372 -0.831 . . . . 0.0 109.891 176.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -49.57 128.61 17.92 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.285 -178.271 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.412 ' O ' ' HG2' ' A' ' 86' ' ' LYS . 38.2 p90 -52.19 -42.78 63.79 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.412 -179.78 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.442 ' O ' HG23 ' A' ' 88' ' ' VAL . 68.7 t60 -68.07 -39.7 82.91 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.674 -0.239 . . . . 0.0 110.88 -178.385 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 40.6 m -63.71 -46.49 85.24 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.917 0.389 . . . . 0.0 110.547 -179.26 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.412 ' HG2' ' O ' ' A' ' 83' ' ' PHE . 12.0 ptmm? -72.12 -21.95 61.4 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.153 179.688 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -69.92 -46.54 65.14 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.227 174.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 84' ' ' HIS . 87.6 t -54.84 -36.98 39.3 Favored 'Isoleucine or valine' 0 C--O 1.235 0.32 0 CA-C-O 121.287 0.565 . . . . 0.0 109.61 175.242 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.409 HD12 ' HA ' ' A' ' 86' ' ' LYS . 74.4 mt -63.15 -46.48 95.84 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.71 176.304 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 72.1 p -63.94 -22.57 66.98 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.067 0.46 . . . . 0.0 111.094 -179.215 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 79.6 m-20 -85.6 -31.1 22.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.542 178.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 20.7 m -98.2 -1.84 41.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.469 -176.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 11.0 tp -66.33 -15.01 18.47 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.391 0 CA-C-O 121.106 0.479 . . . . 0.0 111.238 -176.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 8.0 t -89.3 -6.95 56.31 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.909 178.487 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.489 ' N ' ' HD3' ' A' ' 96' ' ' PRO . 25.5 pt20 -160.79 56.92 0.81 Allowed Pre-proline 0 CA--C 1.536 0.43 0 CA-C-O 120.973 0.416 . . . . 0.0 110.495 -179.132 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.489 ' HD3' ' N ' ' A' ' 95' ' ' GLN . 23.9 Cg_exo -63.06 134.19 44.82 Favored 'Trans proline' 0 C--N 1.351 0.698 0 C-N-CA 122.798 2.332 . . . . 0.0 112.501 -174.4 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.449 ' H ' ' HB2' ' A' ' 100' ' ' SER . 52.7 p -90.87 168.84 11.41 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.434 176.454 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 34.9 tp -55.54 -47.1 76.85 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 120.972 0.415 . . . . 0.0 111.151 -177.538 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . 0.445 ' HB3' ' HB2' ' A' ' 102' ' ' ASP . 45.9 m-70 -108.67 36.98 2.65 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.818 0.342 . . . . 0.0 110.492 178.558 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . 0.449 ' HB2' ' H ' ' A' ' 97' ' ' THR . 15.6 t -59.22 -48.98 79.61 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.064 0.459 . . . . 0.0 110.511 178.341 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.476 ' O ' ' HG3' ' A' ' 105' ' ' GLN . 84.3 m-85 -80.21 -1.52 40.91 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.591 -177.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . 0.445 ' HB2' ' HB3' ' A' ' 99' ' ' HIS . 16.1 t70 -52.88 -42.71 65.54 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 120.993 0.425 . . . . 0.0 110.608 -176.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.58 ' O ' ' HG2' ' A' ' 107' ' ' ARG . . . -57.22 -51.31 69.85 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.464 176.699 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -59.69 -40.18 87.02 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.979 -179.314 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.476 ' HG3' ' O ' ' A' ' 101' ' ' PHE . 25.9 mt-30 -60.63 -43.86 97.04 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.921 178.645 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 25.8 t -62.23 -37.43 85.38 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.605 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . 0.58 ' HG2' ' O ' ' A' ' 103' ' ' ALA . 16.3 mmm180 -65.42 -60.53 2.86 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.051 179.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 53.7 t -53.46 -40.66 41.82 Favored 'Isoleucine or valine' 0 C--O 1.239 0.54 0 CA-C-O 121.39 0.614 . . . . 0.0 110.865 178.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . 0.544 ' HA ' ' HE3' ' A' ' 112' ' ' MET . 30.4 t80 -60.68 -51.89 67.44 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.312 -179.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.585 ' NE2' HD12 ' A' ' 111' ' ' LEU . 0.0 OUTLIER -61.81 -28.83 69.75 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-O 120.485 0.183 . . . . 0.0 110.509 -175.189 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.585 HD12 ' NE2' ' A' ' 110' ' ' GLN . 10.1 mp -60.56 -68.1 0.33 Allowed 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.316 175.179 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . 0.544 ' HE3' ' HA ' ' A' ' 109' ' ' TYR . 0.0 OUTLIER -68.97 -12.46 61.69 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.475 -175.171 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . 0.558 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 44.5 tt0 -64.43 -63.8 1.04 Allowed 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 172.637 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 29.8 pt20 -68.62 -20.69 64.5 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.463 -175.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -95.3 -63.09 1.2 Allowed 'General case' 0 C--O 1.233 0.214 0 CA-C-O 120.748 0.308 . . . . 0.0 111.588 -179.289 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 23.8 m -86.22 -37.23 18.87 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 112.709 0.633 . . . . 0.0 112.709 -170.642 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . 0.558 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 31.3 t80 -64.25 -37.44 87.5 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 120.866 -0.333 . . . . 0.0 110.751 -176.036 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 24.5 p -59.45 -46.38 88.92 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 121.533 0.682 . . . . 0.0 109.74 175.15 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 22.4 mmt180 -60.81 -38.49 85.59 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.48 176.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 88.1 t80 -61.04 -41.12 95.98 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.444 178.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 87.6 mt -69.36 -22.63 63.72 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.309 -178.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . 0.72 ' HA ' ' HE3' ' A' ' 122' ' ' LYS . 0.0 OUTLIER -115.38 15.02 16.86 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.598 0.237 . . . . 0.0 111.602 178.61 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 96.2 p -74.7 145.86 42.76 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 120.939 0.4 . . . . 0.0 111.117 -179.217 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -56.08 -36.59 68.27 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.802 176.735 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.527 ' O ' ' HG ' ' A' ' 129' ' ' LEU . 8.2 tp -66.87 -40.68 86.33 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.553 -179.561 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 84.6 t80 -63.41 -42.88 98.77 Favored 'General case' 0 C--O 1.232 0.175 0 N-CA-C 109.584 -0.524 . . . . 0.0 109.584 176.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 93.3 mt -64.32 -29.4 70.48 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.222 176.601 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -71.14 -29.67 65.52 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.934 177.159 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.527 ' HG ' ' O ' ' A' ' 125' ' ' ILE . 69.6 mt -75.19 -25.41 58.22 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.136 176.197 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -70.23 -67.36 0.5 Allowed 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.417 -179.08 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -96.26 -10.58 27.6 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 120.814 0.34 . . . . 0.0 111.508 -175.134 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . -78.02 61.06 3.8 Favored Glycine 0 C--N 1.33 0.211 0 N-CA-C 110.555 -1.018 . . . . 0.0 110.555 175.33 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 48.0 ttt85 -53.09 111.02 2.31 Favored Pre-proline 0 C--N 1.325 -0.468 0 C-N-CA 123.514 0.726 . . . . 0.0 111.316 -174.351 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo . . . . . 0 C--N 1.35 0.625 0 C-N-CA 122.809 2.339 . . . . 0.0 112.478 -176.807 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 68.4 p . . . . . 0 N--CA 1.479 1.012 0 N-CA-C 110.384 -0.228 . . . . 0.0 110.384 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 65.6 mtt 66.16 -175.33 0.19 Allowed 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.62 178.477 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.454 ' CG2' ' HB3' ' A' ' 7' ' ' GLU . 9.1 p -153.09 149.64 13.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.782 0.325 . . . . 0.0 111.326 -174.721 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 35.4 t -88.15 148.13 42.15 Favored Pre-proline 0 CA--C 1.534 0.344 0 CA-C-N 115.912 -0.585 . . . . 0.0 109.809 177.359 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_exo -45.41 -33.76 9.57 Favored 'Trans proline' 0 C--N 1.357 0.984 0 C-N-CA 123.003 2.468 . . . . 0.0 112.772 178.499 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.441 ' O ' HG22 ' A' ' 9' ' ' VAL . 12.6 mm-40 -53.91 -65.01 0.64 Allowed 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 121.193 0.52 . . . . 0.0 110.734 177.058 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.454 ' HB3' ' CG2' ' A' ' 3' ' ' VAL . 8.1 tp10 -64.57 -33.21 75.39 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.095 -178.372 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.23 -48.24 82.34 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.496 -179.025 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.553 HG23 ' HD2' ' A' ' 10' ' ' LYS . 31.8 m -69.25 -28.52 39.03 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 C-N-CA 120.914 -0.314 . . . . 0.0 110.571 179.781 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.553 ' HD2' HG23 ' A' ' 9' ' ' VAL . 3.1 mptp? -68.59 -29.57 68.13 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.644 0.259 . . . . 0.0 110.689 175.649 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 50.7 m0 -63.89 -32.41 73.92 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 170.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -79.92 0.95 81.29 Favored Glycine 0 C--N 1.331 0.304 0 CA-C-N 115.362 -0.836 . . . . 0.0 113.099 -177.602 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.547 ' HG2' ' HA ' ' A' ' 10' ' ' LYS . 11.2 pt-20 -130.65 0.86 4.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.857 0.36 . . . . 0.0 110.418 177.236 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.1 m -152.46 99.02 2.44 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.494 -179.004 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.405 ' HE2' ' HB2' ' A' ' 117' ' ' TYR . 36.8 t80 -59.48 -36.01 75.2 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.141 0.496 . . . . 0.0 109.765 178.034 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -57.21 -38.31 73.52 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.277 176.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.638 ' HB2' ' NZ ' ' A' ' 17' ' ' LYS . 1.0 OUTLIER -75.69 -30.09 59.22 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.245 -0.888 . . . . 0.0 110.184 -173.37 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 65.8 tp -59.85 -47.2 86.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.68 173.334 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 7.5 mp -77.14 -25.37 51.95 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.987 178.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 42.8 t -62.45 -29.63 70.66 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.388 178.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -95.13 129.8 42.1 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.106 176.142 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.641 HH11 ' HB2' ' A' ' 26' ' ' GLU . 2.1 tmt_? -58.27 -33.46 69.44 Favored 'General case' 0 C--O 1.234 0.289 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 176.557 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -61.85 -52.71 63.03 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.986 177.225 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -63.36 -37.8 95.41 Favored Glycine 0 C--N 1.334 0.419 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.89 -179.298 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 16.1 tp -54.16 -58.09 8.67 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.096 0.474 . . . . 0.0 110.481 175.626 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.641 ' HB2' HH11 ' A' ' 22' ' ' ARG . 15.6 tp10 -65.65 -40.8 92.86 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.534 -176.272 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.43 ' O ' ' HG3' ' A' ' 30' ' ' ARG . . . -61.14 -45.77 93.28 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-O 121.008 0.433 . . . . 0.0 110.71 179.072 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -70.92 -41.11 71.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.899 -177.49 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.531 HG22 ' HA ' ' A' ' 26' ' ' GLU . 14.9 t -69.93 -42.74 72.87 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 120.816 -0.354 . . . . 0.0 110.701 -177.917 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.472 ' NH1' HD11 ' A' ' 125' ' ' ILE . 0.0 OUTLIER -63.58 -27.32 69.17 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 121.037 0.446 . . . . 0.0 109.811 179.245 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.591 ' O ' HG22 ' A' ' 34' ' ' THR . 93.8 t80 -77.12 -44.3 30.92 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.701 -0.682 . . . . 0.0 109.802 174.068 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.417 HD23 ' HA ' ' A' ' 38' ' ' GLU . 22.9 tp -69.82 -16.63 63.31 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.789 -176.426 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.563 ' HG2' ' HG2' ' A' ' 38' ' ' GLU . 98.2 mttt -81.94 -18.21 44.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.492 179.294 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.591 HG22 ' O ' ' A' ' 31' ' ' PHE . 2.5 t -72.03 -28.48 63.39 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 121.286 0.565 . . . . 0.0 109.613 178.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -102.15 -1.64 31.01 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.283 176.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 94.5 m-85 52.63 67.66 0.95 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.373 -179.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 29.5 t -132.42 12.17 4.54 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.926 177.641 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.563 ' HG2' ' HG2' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -63.78 -18.0 63.64 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.969 179.364 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.424 ' HG3' ' N ' ' A' ' 40' ' ' ASN . 7.5 pt-20 -43.56 -42.5 5.08 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.027 171.775 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.485 ' HB3' HG13 ' A' ' 108' ' ' VAL . 57.1 m-80 -64.02 -46.45 84.42 Favored 'General case' 0 C--O 1.243 0.713 0 CA-C-N 115.329 -0.851 . . . . 0.0 111.404 -175.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.449 ' O ' HG13 ' A' ' 45' ' ' ILE . 32.4 mt -60.77 -51.75 69.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.171 179.831 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -64.57 -24.32 67.56 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.293 178.155 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.482 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 84.2 t80 -58.32 -60.98 2.92 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 116.57 -0.286 . . . . 0.0 110.711 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 6.7 p-90 -75.88 -17.73 59.68 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 119.762 -0.775 . . . . 0.0 111.854 -178.537 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.449 HG13 ' O ' ' A' ' 41' ' ' ILE . 33.6 mt -60.76 -47.04 94.9 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 170.578 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.41 -34.75 79.04 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.634 178.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.772 ' SG ' ' HB2' ' A' ' 101' ' ' PHE . 49.8 t -60.95 -41.68 96.78 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.507 178.831 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -71.53 -31.09 66.66 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 121.131 0.491 . . . . 0.0 109.997 179.136 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.773 ' HA ' ' HE2' ' A' ' 52' ' ' LYS . 77.8 m-20 -66.08 -32.12 73.4 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 121.308 0.575 . . . . 0.0 109.748 174.702 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 43.3 t80 -70.0 -35.53 74.44 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.455 176.212 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 6.1 tmtm? -58.9 -35.66 73.41 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.697 175.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.773 ' HE2' ' HA ' ' A' ' 49' ' ' ASP . 1.9 mppt? -58.25 -47.7 82.73 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.022 175.481 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.401 ' HB2' ' CG ' ' A' ' 58' ' ' GLN . 6.2 p -74.52 79.66 1.95 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.199 0.523 . . . . 0.0 110.627 -178.451 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.63 11.32 9.11 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 115.438 -0.801 . . . . 0.0 112.525 -176.299 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . 0.541 ' O ' HG12 ' A' ' 59' ' ' ILE . . . -69.3 126.61 19.77 Favored Glycine 0 CA--C 1.52 0.383 0 C-N-CA 120.81 -0.709 . . . . 0.0 111.521 177.344 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -52.84 -47.75 25.73 Favored 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 122.734 2.29 . . . . 0.0 113.081 -174.169 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 69.4 mt-30 -75.22 -40.85 58.76 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 178.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.557 ' O ' ' HB2' ' A' ' 62' ' ' LYS . 27.8 tp60 -51.17 -39.19 55.82 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 114.858 -1.065 . . . . 0.0 110.704 178.933 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.541 HG12 ' O ' ' A' ' 55' ' ' GLY . 29.6 mm -50.59 -48.41 26.85 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.596 179.527 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 46.2 m-70 -68.07 -54.23 19.73 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.994 -173.026 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.498 HD11 HE22 ' A' ' 58' ' ' GLN . 3.7 pp -69.42 -25.81 64.31 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.084 -176.704 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.557 ' HB2' ' O ' ' A' ' 58' ' ' GLN . 2.0 tmtm? -70.21 -45.73 66.0 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 175.473 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.51 -32.66 71.67 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.545 177.11 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.421 ' O ' ' HB3' ' A' ' 67' ' ' TYR . 16.2 tppt? -58.94 -46.93 86.81 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 120.952 0.406 . . . . 0.0 110.267 174.921 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -61.23 -43.77 98.34 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.599 179.067 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 64.0 mt -68.76 -29.46 43.71 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.312 178.072 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.589 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 92.0 t80 -61.65 -63.83 1.14 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.325 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -61.22 -37.07 81.7 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.711 -175.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -83.46 -37.91 22.54 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -173.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -120.67 -50.14 2.21 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -171.506 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.589 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 49.2 mm -71.67 -31.08 40.68 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.363 0 CA-C-O 120.49 0.185 . . . . 0.0 111.36 -169.176 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 12.2 mm-40 -58.15 145.64 36.27 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.168 0.509 . . . . 0.0 111.233 178.513 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 27.7 m -77.47 -45.95 24.05 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 169.756 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -85.49 60.79 6.46 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.569 172.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.581 ' HB3' ' HA ' ' A' ' 78' ' ' GLU . . . -97.76 161.18 26.6 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.315 -178.685 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_exo -49.6 -53.25 7.35 Favored 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 122.798 2.332 . . . . 0.0 112.745 179.216 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.524 ' O ' ' HD3' ' A' ' 77' ' ' LYS . 1.4 tmtp? -108.99 -23.25 11.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.01 -179.126 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.581 ' HA ' ' HB3' ' A' ' 75' ' ' ALA . 36.4 mt-10 70.4 156.38 0.15 Allowed 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.435 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.44 HG12 ' H ' ' A' ' 81' ' ' LEU . 50.7 t -130.5 133.09 64.18 Favored 'Isoleucine or valine' 0 C--O 1.235 0.327 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.643 176.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 35.9 m-80 -79.48 20.49 0.55 Allowed 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 122.617 0.367 . . . . 0.0 111.869 -176.326 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.44 ' H ' HG12 ' A' ' 79' ' ' VAL . 14.1 tp -62.93 147.42 50.44 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.899 176.814 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -46.57 126.34 8.17 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.852 178.641 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.547 ' HA ' ' HD3' ' A' ' 86' ' ' LYS . 87.1 t80 -57.02 -39.58 75.04 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.181 -178.368 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 83.2 t60 -66.01 -29.74 70.16 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.714 0.292 . . . . 0.0 110.834 -178.266 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 56.8 m -71.43 -46.66 59.52 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 175.454 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.565 ' O ' HG23 ' A' ' 90' ' ' THR . 26.1 mtpp -55.99 -41.49 74.92 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.584 175.223 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -52.9 -59.72 4.17 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 114.887 -1.051 . . . . 0.0 111.107 -179.928 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 61.3 t -56.49 -40.71 69.57 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.908 -178.104 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 75.2 mt -66.92 -47.7 81.73 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.19 -178.113 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.565 HG23 ' O ' ' A' ' 86' ' ' LYS . 82.8 p -59.8 -31.27 69.55 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-O 120.922 0.392 . . . . 0.0 111.117 -176.694 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 -85.13 -24.5 27.98 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.99 -179.784 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 32.3 t -97.0 2.14 51.11 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.515 -0.311 . . . . 0.0 110.802 -179.647 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.5 tp -53.3 -29.98 16.79 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 CA-C-N 116.429 -0.35 . . . . 0.0 111.819 -177.156 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 8.8 t -61.85 -38.39 88.06 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.955 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 80.2 mt-30 -141.91 81.0 15.0 Favored Pre-proline 0 N--CA 1.464 0.259 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.502 -179.652 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.45 ' HG2' HG22 ' A' ' 59' ' ' ILE . 93.2 Cg_endo -86.62 143.33 7.26 Favored 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 122.662 2.241 . . . . 0.0 111.706 176.566 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.448 ' H ' ' HB3' ' A' ' 100' ' ' SER . 36.7 p -79.39 171.55 15.01 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.135 177.559 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 36.2 tp -57.54 -30.63 65.36 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.61 -174.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . 0.435 ' O ' ' HB2' ' A' ' 102' ' ' ASP . 0.1 OUTLIER -132.63 43.55 2.97 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 177.939 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . 0.448 ' HB3' ' H ' ' A' ' 97' ' ' THR . 6.3 p -53.12 -33.47 52.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.428 -0.806 . . . . 0.0 112.076 -178.723 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.772 ' HB2' ' SG ' ' A' ' 47' ' ' CYS . 38.7 m-85 -83.2 9.38 10.74 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.223 -176.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . 0.435 ' HB2' ' O ' ' A' ' 99' ' ' HIS . 19.0 t70 -56.94 -44.75 82.84 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 121.009 0.433 . . . . 0.0 110.966 -176.371 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.01 -31.98 71.58 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.57 178.078 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.425 ' HB3' ' O ' ' A' ' 101' ' ' PHE . . . -66.46 -37.03 84.23 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.498 179.842 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.402 ' OE1' ' HA ' ' A' ' 102' ' ' ASP . 1.4 mp0 -54.57 -41.68 70.13 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 120.826 0.346 . . . . 0.0 110.288 176.209 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 49.0 m -62.24 -53.37 56.13 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.592 -179.269 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 39.5 mmt-85 -57.49 -48.97 77.8 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.239 -179.679 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.485 HG13 ' HB3' ' A' ' 40' ' ' ASN . 71.2 t -64.29 -52.52 54.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.863 -176.027 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -56.11 -53.74 53.37 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.462 -176.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.1 -31.02 71.21 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.834 -175.043 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 54.4 tp -65.24 -47.97 74.92 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.506 -179.224 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 62.8 mtm -62.33 -39.35 92.78 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.176 0.512 . . . . 0.0 110.146 178.133 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . 0.612 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 38.4 tt0 -58.93 -62.5 1.83 Allowed 'General case' 0 C--O 1.235 0.317 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.302 -175.848 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -54.4 -31.56 55.24 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 112.866 0.691 . . . . 0.0 112.866 -169.338 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -105.28 -63.21 1.26 Allowed 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 112.085 0.402 . . . . 0.0 112.085 -175.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 22.5 t -70.52 -42.3 71.44 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.686 0.279 . . . . 0.0 111.101 -173.52 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . 0.612 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 28.3 t80 -67.48 -35.77 79.82 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-N 116.725 -0.216 . . . . 0.0 111.321 -175.495 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 29.8 p -65.45 -49.54 68.77 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-O 120.856 0.36 . . . . 0.0 110.366 178.538 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 38.4 ttt180 -62.54 -34.33 76.71 Favored 'General case' 0 C--O 1.225 -0.201 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 176.127 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 83.5 t80 -61.35 -33.85 74.32 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.198 177.223 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 81.5 mt -68.96 -24.74 64.29 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.767 0.317 . . . . 0.0 110.737 177.117 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 17.7 tptt -113.39 15.08 19.24 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 120.963 -0.295 . . . . 0.0 111.576 177.53 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 92.5 p -73.14 157.92 36.29 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.637 0.256 . . . . 0.0 110.53 -179.506 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -55.17 -28.32 52.02 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.041 0.448 . . . . 0.0 110.067 175.362 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.472 HD11 ' NH1' ' A' ' 30' ' ' ARG . 58.9 mt -62.43 -56.75 15.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.452 177.148 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' TYR . . . . . 0.51 ' OH ' ' HA ' ' A' ' 9' ' ' VAL . 32.0 t80 -70.21 -39.37 75.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.555 -175.004 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 98.5 mt -60.72 -32.28 71.55 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 121.099 0.476 . . . . 0.0 110.062 177.022 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -66.82 -36.84 83.29 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.231 177.053 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 72.4 mt -74.25 -29.26 61.6 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.753 177.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' MET . . . . . . . . . . . . . 21.3 mmt -85.93 10.81 12.93 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.425 -177.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 9.3 tp10 -55.52 98.0 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.297 0.57 . . . . 0.0 111.72 -177.017 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 83.79 -61.72 4.7 Favored Glycine 0 N--CA 1.45 -0.383 0 CA-C-N 115.493 -0.776 . . . . 0.0 113.458 171.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . 0.524 ' HD2' ' N ' ' A' ' 133' ' ' ARG . 3.2 mpt_? -95.51 126.57 45.16 Favored Pre-proline 0 C--N 1.327 -0.407 0 O-C-N 122.851 -0.205 . . . . 0.0 111.462 -171.43 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo . . . . . 0 C--N 1.35 0.617 0 C-N-CA 123.486 2.791 . . . . 0.0 111.489 175.18 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 33.8 m . . . . . 0 N--CA 1.476 0.858 0 CA-C-O 120.789 0.328 . . . . 0.0 110.373 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 23.8 mmt -136.45 97.18 3.51 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.756 176.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 2.6 p -66.09 137.87 24.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.151 -179.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.6 m -119.75 162.37 33.2 Favored Pre-proline 0 CA--C 1.534 0.333 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.39 178.335 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo -41.83 -48.53 5.92 Favored 'Trans proline' 0 C--N 1.356 0.921 0 C-N-CA 123.16 2.574 . . . . 0.0 113.339 -179.802 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.639 ' O ' ' HG2' ' A' ' 10' ' ' LYS . 49.9 mt-10 -62.81 -40.81 98.51 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 120.749 0.309 . . . . 0.0 110.978 179.765 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 15.4 tp10 -63.47 -36.41 83.65 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.185 0.517 . . . . 0.0 109.729 177.765 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.08 -41.0 91.29 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.263 -179.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.578 HG22 ' O ' ' A' ' 6' ' ' GLU . 16.3 m -69.97 -25.11 27.27 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.239 0 C-N-CA 120.797 -0.361 . . . . 0.0 110.42 179.918 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.639 ' HG2' ' O ' ' A' ' 6' ' ' GLU . 74.6 mmtt -64.12 -32.22 73.7 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 121.377 0.608 . . . . 0.0 109.667 175.199 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 31.4 m0 -79.36 -33.49 42.89 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.741 -0.663 . . . . 0.0 109.437 176.594 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -72.38 -0.49 46.71 Favored Glycine 0 C--N 1.334 0.441 0 CA-C-N 115.308 -0.86 . . . . 0.0 112.975 -179.577 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 17.3 pt-20 -115.51 -4.66 12.26 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 116.848 0.324 . . . . 0.0 110.889 176.506 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 43.7 t -165.32 111.05 0.92 Allowed 'General case' 0 C--O 1.234 0.264 0 CA-C-O 120.862 0.363 . . . . 0.0 111.247 -177.707 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 41.4 t80 -63.15 -32.95 74.46 Favored 'General case' 0 CA--C 1.53 0.192 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 174.381 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -58.75 -39.44 80.95 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.034 -0.984 . . . . 0.0 110.588 174.656 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.47 ' HD2' ' O ' ' A' ' 10' ' ' LYS . 38.8 ttmt -76.27 -33.86 59.12 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.402 -179.878 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 53.4 tp -55.76 -46.62 77.84 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 121.203 0.525 . . . . 0.0 110.197 176.16 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.451 HD23 ' CZ2' ' A' ' 44' ' ' TRP . 4.4 mp -76.05 -23.77 55.11 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.851 179.748 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 15.0 t -70.97 -25.73 62.84 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.927 -179.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -97.8 123.53 41.8 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 69.4 mtp180 -52.66 -39.47 61.87 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-O 120.738 0.304 . . . . 0.0 110.859 -179.147 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -54.84 -47.25 74.38 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.683 -0.69 . . . . 0.0 109.996 177.613 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -71.21 -40.23 61.49 Favored Glycine 0 N--CA 1.45 -0.367 0 CA-C-N 115.385 -0.825 . . . . 0.0 112.0 -179.119 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.425 ' O ' HG22 ' A' ' 29' ' ' THR . 10.0 tt -58.66 -47.99 82.58 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.994 -0.373 . . . . 0.0 109.994 178.635 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 -57.42 -57.14 13.95 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.333 178.331 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -58.38 -40.81 83.34 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.854 -0.612 . . . . 0.0 111.361 -177.346 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 93.2 t80 -74.31 -40.99 61.87 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.722 -175.572 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.626 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 11.7 t -72.54 -41.12 66.15 Favored 'General case' 0 CA--C 1.515 -0.39 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 -175.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 11.0 ttm180 -56.18 -42.16 76.64 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.167 173.433 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.509 ' O ' HG22 ' A' ' 34' ' ' THR . 89.1 t80 -67.46 -28.98 68.32 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.993 179.063 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 32.4 tp -86.58 -27.61 23.8 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 121.062 0.458 . . . . 0.0 110.869 -178.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.626 ' HG3' ' O ' ' A' ' 29' ' ' THR . 68.3 mttm -72.57 -17.93 61.66 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.874 179.807 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.509 HG22 ' O ' ' A' ' 31' ' ' PHE . 4.3 t -62.15 -27.25 68.81 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 120.915 0.388 . . . . 0.0 110.471 179.351 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -111.55 5.83 19.7 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.759 179.655 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 63.05 24.49 14.53 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 115.782 -0.645 . . . . 0.0 112.36 176.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 28.5 m -97.19 19.23 13.36 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.298 0.57 . . . . 0.0 110.279 177.246 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.537 ' HB3' ' HG2' ' A' ' 33' ' ' LYS . 11.8 pt-20 -62.14 -24.96 67.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.24 -0.891 . . . . 0.0 112.332 -173.604 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.447 ' O ' ' HB2' ' A' ' 43' ' ' PHE . 11.3 mp0 -51.61 -22.3 3.22 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 112.24 0.459 . . . . 0.0 112.24 -176.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.576 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 47.4 m-80 -71.65 -60.84 2.02 Favored 'General case' 0 C--O 1.242 0.676 0 CA-C-O 121.115 0.483 . . . . 0.0 110.901 -179.738 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.457 ' O ' HG13 ' A' ' 45' ' ' ILE . 8.4 tt -62.69 -41.02 90.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 179.37 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.457 ' OE1' ' HB2' ' A' ' 38' ' ' GLU . 0.9 OUTLIER -64.74 -27.0 68.61 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.068 176.227 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.576 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 77.6 t80 -58.85 -59.03 6.1 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 120.703 0.287 . . . . 0.0 110.536 178.061 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.451 ' CZ2' HD23 ' A' ' 19' ' ' LEU . 28.5 p-90 -74.34 -14.79 60.93 Favored 'General case' 0 C--N 1.331 -0.207 0 C-N-CA 119.377 -0.929 . . . . 0.0 111.665 -177.162 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.457 HG13 ' O ' ' A' ' 41' ' ' ILE . 68.2 mt -71.16 -37.3 66.03 Favored 'Isoleucine or valine' 0 C--O 1.238 0.461 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 169.231 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.59 -27.04 68.68 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 115.713 -0.676 . . . . 0.0 109.961 175.473 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.442 ' SG ' ' HB2' ' A' ' 101' ' ' PHE . 53.1 t -62.44 -29.05 70.23 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.038 175.258 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.509 ' O ' ' HG2' ' A' ' 51' ' ' LYS . 19.1 mt-10 -72.31 -41.0 67.07 Favored 'General case' 0 N--CA 1.458 -0.058 0 N-CA-C 109.784 -0.451 . . . . 0.0 109.784 174.397 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -61.36 -26.38 67.79 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.025 0.44 . . . . 0.0 110.377 174.075 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -73.95 -46.14 45.89 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.984 177.4 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.509 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 64.3 pttt -70.2 -23.1 62.89 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 116.759 -0.2 . . . . 0.0 111.422 -175.459 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.478 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 19.3 ptmt -90.37 7.96 35.95 Favored 'General case' 0 N--CA 1.467 0.386 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -177.367 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 65.9 m -54.54 119.16 4.86 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 120.807 0.337 . . . . 0.0 110.443 178.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.14 -19.45 65.6 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.782 -175.673 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -125.4 148.47 16.88 Favored Glycine 0 C--N 1.331 0.304 0 C-N-CA 120.95 -0.643 . . . . 0.0 112.402 -177.231 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -67.93 -32.55 28.55 Favored 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.683 2.255 . . . . 0.0 111.987 -179.082 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -71.66 -34.48 69.77 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 177.734 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 56.6 tp60 -58.7 -32.45 69.18 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.123 178.745 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.498 HG22 ' HG2' ' A' ' 96' ' ' PRO . 33.9 mm -55.23 -45.44 77.54 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.496 175.668 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 40.5 m-70 -66.19 -40.92 90.76 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.115 -178.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 77.6 mt -63.91 -49.99 70.49 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.02 -178.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.561 ' HE2' ' HA ' ' A' ' 62' ' ' LYS . 9.0 mmpt? -65.55 -42.98 91.26 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.833 -178.701 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.58 -46.78 86.21 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.804 179.648 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 6.7 tmtt? -63.39 -37.04 85.72 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.238 179.315 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.16 -51.91 65.93 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.561 179.054 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 72.6 mt -62.38 -36.01 72.51 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.193 178.46 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.587 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 74.3 t80 -58.48 -63.89 1.12 Allowed 'General case' 0 C--O 1.236 0.346 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.489 178.849 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -54.72 -40.12 68.91 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 115.241 -0.89 . . . . 0.0 111.984 -174.608 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 56.3 tttm -96.41 -16.64 21.11 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 112.478 0.547 . . . . 0.0 112.478 -168.085 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -135.02 -53.37 0.8 Allowed 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 112.705 0.632 . . . . 0.0 112.705 -174.522 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.587 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 48.5 mm -67.41 -41.69 86.48 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 CA-C-O 120.618 0.247 . . . . 0.0 111.401 -170.047 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 51.2 tp60 -50.69 131.46 25.66 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.509 -178.358 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 20.4 m -54.82 -31.49 59.25 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.808 -174.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -114.9 32.52 5.97 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 121.049 0.452 . . . . 0.0 110.749 -178.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.546 ' HB3' ' HA ' ' A' ' 78' ' ' GLU . . . -60.44 158.61 28.53 Favored Pre-proline 0 CA--C 1.537 0.481 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.056 179.108 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.486 ' HD2' ' HB1' ' A' ' 75' ' ' ALA . 2.0 Cg_endo -44.05 -54.31 3.96 Favored 'Trans proline' 0 C--N 1.358 1.031 0 C-N-CA 123.672 2.915 . . . . 0.0 113.458 -175.579 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.411 ' O ' ' HG2' ' A' ' 78' ' ' GLU . 43.2 mtpt -107.16 -19.28 13.65 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 110.313 -0.254 . . . . 0.0 110.313 175.16 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.546 ' HA ' ' HB3' ' A' ' 75' ' ' ALA . 10.0 pt-20 52.89 162.84 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.969 1.308 . . . . 0.0 113.282 -179.855 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 64.5 t -126.87 137.57 57.46 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 CA-C-N 114.856 -1.066 . . . . 0.0 108.835 174.572 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.413 ' HB2' HD21 ' A' ' 111' ' ' LEU . 17.6 m120 -74.63 20.56 0.12 Allowed 'General case' 0 N--CA 1.469 0.513 0 O-C-N 123.272 0.358 . . . . 0.0 111.851 -176.34 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.433 ' O ' ' HE3' ' A' ' 86' ' ' LYS . 61.9 tp -50.07 134.42 21.93 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.487 175.034 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -47.43 140.59 5.6 Favored 'General case' 0 N--CA 1.469 0.475 0 O-C-N 123.475 0.484 . . . . 0.0 111.974 -177.744 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 99.1 m-85 -58.25 -48.27 80.97 Favored 'General case' 0 C--N 1.333 -0.109 0 CA-C-N 115.592 -0.731 . . . . 0.0 110.705 -177.375 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.406 ' O ' ' HB3' ' A' ' 87' ' ' GLU . 83.1 t60 -59.89 -37.31 79.02 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.048 -179.478 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 25.8 m -67.88 -49.94 59.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.872 -178.547 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.55 ' O ' HG23 ' A' ' 90' ' ' THR . 17.9 ptpt -72.55 -21.33 61.18 Favored 'General case' 0 C--O 1.227 -0.112 0 C-N-CA 120.773 -0.371 . . . . 0.0 110.451 179.278 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.406 ' HB3' ' O ' ' A' ' 84' ' ' HIS . 14.4 tp10 -57.89 -55.23 37.52 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 173.641 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 59.7 t -52.84 -49.37 47.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.926 176.47 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 68.3 mt -58.27 -44.14 87.49 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.853 -177.822 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.55 HG23 ' O ' ' A' ' 86' ' ' LYS . 64.2 p -61.28 -29.21 69.72 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-O 120.791 0.329 . . . . 0.0 110.824 -177.618 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 56.5 m-80 -88.51 -37.81 15.46 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.669 179.678 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 61.9 p -100.53 11.45 39.44 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 112.011 0.375 . . . . 0.0 112.011 -174.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.3 tp -58.37 -24.58 25.17 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.505 0 CA-C-O 120.984 0.421 . . . . 0.0 111.391 -178.457 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 8.8 t -76.45 -15.78 59.83 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.588 -179.199 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 16.3 pt20 -135.41 58.69 27.18 Favored Pre-proline 0 CA--C 1.538 0.496 0 CA-C-O 120.903 0.382 . . . . 0.0 110.979 -177.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.498 ' HG2' HG22 ' A' ' 59' ' ' ILE . 85.3 Cg_endo -81.62 122.47 4.0 Favored 'Trans proline' 0 C--N 1.348 0.533 0 C-N-CA 122.656 2.237 . . . . 0.0 112.401 -176.309 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 11.5 m -71.42 161.7 30.62 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.197 177.762 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -51.21 -38.74 54.09 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 122.502 0.321 . . . . 0.0 111.654 -177.611 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 28.7 m-70 -113.21 38.88 2.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.075 0.464 . . . . 0.0 110.884 178.545 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 17.2 p -62.29 -53.07 60.48 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.254 0.55 . . . . 0.0 110.476 177.031 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.442 ' HB2' ' SG ' ' A' ' 47' ' ' CYS . 94.8 m-85 -74.11 -0.98 18.27 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.358 -179.801 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . 0.502 ' O ' ' HB3' ' A' ' 105' ' ' GLN . 14.6 t70 -61.71 -33.25 73.69 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.13 0.49 . . . . 0.0 109.966 178.621 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.29 -41.57 96.82 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.896 174.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.94 -29.6 69.51 Favored 'General case' 0 C--N 1.333 -0.15 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.198 177.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.502 ' HB3' ' O ' ' A' ' 102' ' ' ASP . 21.7 tm0? -56.03 -52.29 64.77 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.922 177.005 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 31.5 t -62.06 -38.47 88.92 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.559 179.813 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . 0.416 ' O ' ' HG2' ' A' ' 110' ' ' GLN . 6.2 mmp_? -61.3 -54.43 44.05 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.951 179.315 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 96.8 t -64.56 -36.63 77.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-O 121.309 0.576 . . . . 0.0 110.369 -179.31 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -55.99 -50.57 70.46 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.737 176.477 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.416 ' HG2' ' O ' ' A' ' 107' ' ' ARG . 3.5 pt20 -73.76 -29.21 62.08 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 120.821 0.344 . . . . 0.0 110.551 -179.205 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.44 ' O ' ' HG2' ' A' ' 114' ' ' GLN . 57.0 tp -62.85 -43.52 98.58 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.494 179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 58.8 mtm -75.63 -35.44 60.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.052 177.41 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . 0.439 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 3.7 tm-20 -52.31 -53.46 44.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.938 -177.811 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . 0.44 ' HG2' ' O ' ' A' ' 111' ' ' LEU . 4.3 pt20 -54.29 -17.04 2.52 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 112.732 0.641 . . . . 0.0 112.732 -172.831 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 42.4 m-20 -124.88 -68.16 0.87 Allowed 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 121.225 0.536 . . . . 0.0 110.795 178.515 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 5.0 m -59.09 -29.7 67.55 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.422 -0.808 . . . . 0.0 112.455 -171.309 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . 0.439 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 19.6 t80 -65.87 -59.07 4.22 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 120.55 0.214 . . . . 0.0 110.93 -177.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 1.3 p -60.97 -38.35 85.65 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.657 0.265 . . . . 0.0 110.926 179.278 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 78.9 mtp85 -58.15 -42.31 85.62 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 121.001 0.429 . . . . 0.0 110.01 175.194 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -64.14 -38.99 93.03 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.416 178.045 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 92.8 mt -66.76 -21.62 66.05 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.232 -179.217 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? -108.75 -0.94 19.72 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 120.662 0.268 . . . . 0.0 111.488 179.442 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 80.4 p -66.3 152.69 44.42 Favored 'General case' 0 C--O 1.237 0.407 0 O-C-N 122.256 -0.277 . . . . 0.0 110.519 179.613 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -54.47 -31.88 56.61 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 175.717 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.558 ' O ' ' HG ' ' A' ' 129' ' ' LEU . 72.9 mt -55.66 -59.06 2.96 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.174 0 CA-C-N 115.177 -0.919 . . . . 0.0 110.678 178.518 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 58.4 t80 -59.53 -43.94 93.33 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.021 -174.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -66.44 -31.55 72.38 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.794 179.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -71.04 -35.41 71.96 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.015 177.656 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.558 ' HG ' ' O ' ' A' ' 125' ' ' ILE . 47.8 mt -59.88 -40.46 88.77 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.915 178.358 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' MET . . . . . . . . . . . . . 23.5 mmt -64.62 -63.97 0.99 Allowed 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.835 175.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . 0.735 ' HG2' ' H ' ' A' ' 133' ' ' ARG . 0.0 OUTLIER -176.08 -40.21 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.182 175.14 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 56.98 30.63 60.54 Favored Glycine 0 C--N 1.333 0.384 0 C-N-CA 121.175 -0.536 . . . . 0.0 112.192 -178.139 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . 0.735 ' H ' ' HG2' ' A' ' 131' ' ' GLU . 77.6 ttt180 -152.95 85.62 4.29 Favored Pre-proline 0 C--O 1.234 0.286 0 CA-C-O 120.625 0.25 . . . . 0.0 110.965 -177.762 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_endo . . . . . 0 N--CA 1.457 -0.646 0 C-N-CA 122.909 2.406 . . . . 0.0 110.443 168.557 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 47.6 t . . . . . 0 N--CA 1.476 0.844 0 CA-C-O 121.103 0.478 . . . . 0.0 110.196 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 26.4 mmt -128.22 17.63 6.57 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 176.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.634 HG11 HD13 ' A' ' 129' ' ' LEU . 2.9 p -106.56 131.05 57.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.068 -0.969 . . . . 0.0 111.792 -173.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.417 ' OG ' ' HD2' ' A' ' 5' ' ' PRO . 47.1 t -100.24 156.58 35.11 Favored Pre-proline 0 C--N 1.326 -0.415 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 170.817 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.417 ' HD2' ' OG ' ' A' ' 4' ' ' SER . 72.3 Cg_exo -42.62 -37.88 5.9 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 122.519 2.146 . . . . 0.0 112.73 176.8 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.564 ' O ' HG22 ' A' ' 9' ' ' VAL . 7.0 mm-40 -67.4 -43.12 82.06 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 121.603 0.716 . . . . 0.0 110.16 176.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.518 ' HB3' HG23 ' A' ' 3' ' ' VAL . 14.8 tp10 -67.46 -23.31 65.49 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.379 -0.828 . . . . 0.0 109.973 178.922 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -73.9 -47.22 39.45 Favored 'General case' 0 C--O 1.234 0.259 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.792 178.644 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.564 HG22 ' O ' ' A' ' 6' ' ' GLU . 19.3 m -63.42 -24.13 35.09 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 C-N-CA 121.091 -0.244 . . . . 0.0 110.527 179.745 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.511 ' O ' ' HD2' ' A' ' 17' ' ' LYS . 32.6 mmtp -51.99 -46.91 65.06 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-O 121.343 0.592 . . . . 0.0 110.224 172.175 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 33.5 m0 -64.51 -28.22 69.51 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.563 -176.163 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -74.62 -11.04 83.12 Favored Glycine 0 N--CA 1.452 -0.256 0 CA-C-N 115.818 -0.628 . . . . 0.0 112.401 179.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -80.98 -24.77 37.79 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 120.831 0.348 . . . . 0.0 110.543 179.112 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 45.8 t -172.57 131.88 0.57 Allowed 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.661 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -61.52 -25.5 67.32 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.649 174.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -68.65 -35.71 77.62 Favored 'General case' 0 N--CA 1.461 0.114 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.007 176.129 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.511 ' HD2' ' O ' ' A' ' 10' ' ' LYS . 35.6 ttmt -70.25 -36.92 74.78 Favored 'General case' 0 C--N 1.334 -0.108 0 CA-C-N 115.998 -0.546 . . . . 0.0 109.928 179.313 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 48.8 tp -58.43 -45.89 87.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.201 174.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.7 mp -74.78 -30.64 61.5 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.932 -177.311 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 69.7 p -78.35 -27.19 46.95 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-O 120.945 0.402 . . . . 0.0 110.364 178.787 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 24.0 t-80 -72.75 110.3 6.98 Favored 'General case' 0 C--O 1.221 -0.4 0 N-CA-C 108.506 -0.924 . . . . 0.0 108.506 176.305 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.18 -53.49 16.67 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 121.2 0.524 . . . . 0.0 111.019 -175.238 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -68.81 -20.66 64.33 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.827 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -78.56 -53.41 4.68 Favored Glycine 0 C--N 1.332 0.329 0 CA-C-N 115.85 -0.613 . . . . 0.0 111.795 -179.461 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.9 tt -51.71 -38.4 54.99 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 123.223 0.609 . . . . 0.0 110.682 174.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.634 ' O ' ' HG2' ' A' ' 30' ' ' ARG . 10.5 tp10 -62.35 -53.67 51.65 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.88 176.847 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -55.37 -44.97 76.55 Favored 'General case' 0 C--O 1.239 0.507 0 CA-C-O 121.293 0.568 . . . . 0.0 110.932 179.772 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.416 ' CE2' HD22 ' A' ' 32' ' ' LEU . 75.3 t80 -64.2 -44.14 92.89 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.872 -179.274 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.604 HG22 ' O ' ' A' ' 26' ' ' GLU . 4.0 t -67.01 -27.79 67.71 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 120.772 -0.371 . . . . 0.0 110.067 -177.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.634 ' HG2' ' O ' ' A' ' 26' ' ' GLU . 35.0 mmt180 -54.95 -52.89 61.6 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 173.305 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.581 ' O ' HG22 ' A' ' 34' ' ' THR . 84.3 t80 -68.21 -45.59 72.94 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.945 -179.141 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.416 HD22 ' CE2' ' A' ' 28' ' ' PHE . 21.5 tp -63.56 -29.85 71.04 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.003 0.43 . . . . 0.0 111.179 -175.344 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.433 ' HE2' ' OG1' ' A' ' 29' ' ' THR . 67.6 mttm -80.75 -9.69 59.78 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.559 179.295 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.581 HG22 ' O ' ' A' ' 31' ' ' PHE . 0.7 OUTLIER -84.13 -28.28 27.56 Favored 'General case' 0 N--CA 1.465 0.28 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 177.955 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -98.41 4.67 48.47 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.716 178.113 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 87.1 m-85 65.16 18.01 11.27 Favored 'General case' 0 N--CA 1.468 0.452 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.811 176.051 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 25.5 m -97.21 15.01 23.97 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 121.045 0.45 . . . . 0.0 110.641 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -56.08 -24.23 38.77 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.338 -179.587 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -45.62 -43.6 12.43 Favored 'General case' 0 C--O 1.225 -0.203 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.628 176.7 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.523 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 2.0 m-20 -57.67 -59.24 5.5 Favored 'General case' 0 C--O 1.245 0.837 0 CA-C-O 121.448 0.642 . . . . 0.0 112.007 -175.288 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.473 ' O ' HG13 ' A' ' 45' ' ' ILE . 13.2 tt -61.64 -42.4 94.05 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.205 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.043 -175.807 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.473 ' HA ' ' HB ' ' A' ' 45' ' ' ILE . 49.3 mt-10 -78.96 -10.01 59.69 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.069 -178.943 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.523 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 72.5 t80 -67.73 -59.28 3.44 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 175.311 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.442 ' HA ' ' SG ' ' A' ' 47' ' ' CYS . 32.1 p-90 -76.06 -19.01 58.97 Favored 'General case' 0 N--CA 1.463 0.215 0 C-N-CA 119.887 -0.725 . . . . 0.0 111.414 -178.861 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.473 HG13 ' O ' ' A' ' 41' ' ' ILE . 54.7 mt -62.92 -39.53 85.43 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 169.901 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.24 -35.64 81.67 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.214 175.408 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.442 ' SG ' ' HA ' ' A' ' 44' ' ' TRP . 67.4 m -63.94 -33.55 75.97 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.32 177.03 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.662 ' O ' ' HG2' ' A' ' 51' ' ' LYS . 9.0 mm-40 -66.72 -52.89 39.29 Favored 'General case' 0 C--O 1.233 0.198 0 N-CA-C 109.546 -0.539 . . . . 0.0 109.546 173.4 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -53.31 -26.31 18.22 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.349 0.595 . . . . 0.0 110.325 178.265 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.404 ' HD1' ' HD3' ' A' ' 62' ' ' LYS . 41.8 t80 -74.28 -40.3 62.4 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.334 177.48 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.662 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 59.9 pttt -66.94 -18.13 65.24 Favored 'General case' 0 N--CA 1.471 0.591 0 O-C-N 121.993 -0.442 . . . . 0.0 110.777 -178.302 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -72.7 -27.3 61.99 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.859 177.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 67.1 p -59.73 124.04 18.87 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 121.092 0.472 . . . . 0.0 110.419 -177.374 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.98 -14.23 16.03 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.752 -177.892 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -83.39 119.39 4.88 Favored Glycine 0 N--CA 1.448 -0.505 0 CA-C-N 115.934 -0.576 . . . . 0.0 112.03 -179.082 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_exo -53.15 -33.54 64.68 Favored 'Trans proline' 0 C--N 1.348 0.514 0 C-N-CA 122.86 2.373 . . . . 0.0 112.014 179.062 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 20.3 mp0 -71.67 -39.66 70.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.502 -0.772 . . . . 0.0 109.614 178.495 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 55.4 tp60 -61.83 -40.55 95.66 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.216 -0.902 . . . . 0.0 110.26 -178.341 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 44.4 mm -49.53 -51.35 15.12 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.248 0 CA-C-N 115.901 -0.591 . . . . 0.0 110.972 -178.853 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 79.2 m-70 -64.43 -55.1 23.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.692 -0.686 . . . . 0.0 111.688 -175.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.502 HD12 ' N ' ' A' ' 62' ' ' LYS . 4.3 pp -71.22 -30.16 66.01 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.805 -173.277 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.502 ' N ' HD12 ' A' ' 61' ' ' LEU . 57.6 tttp -74.29 -43.4 56.96 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 -179.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.33 -36.05 82.41 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.252 176.033 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 6.7 tmtt? -63.18 -36.76 84.71 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 115.659 -0.7 . . . . 0.0 109.971 179.026 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -66.87 -55.42 14.84 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.482 177.585 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 66.9 mt -56.31 -35.68 43.93 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.338 0 CA-C-O 121.365 0.602 . . . . 0.0 110.238 178.431 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 76.2 t80 -56.08 -56.85 15.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.071 -0.968 . . . . 0.0 110.52 178.11 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.486 ' HA ' ' HB2' ' A' ' 72' ' ' GLN . 34.3 mt-10 -77.88 -18.22 56.43 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.543 -174.638 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -82.06 -36.73 27.38 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.319 -0.401 . . . . 0.0 111.132 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -126.47 -51.55 1.5 Allowed 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 112.135 0.421 . . . . 0.0 112.135 -174.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 33.7 mm -71.98 -15.51 18.11 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.373 0 CA-C-O 121.063 0.459 . . . . 0.0 111.34 -171.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.486 ' HB2' ' HA ' ' A' ' 68' ' ' GLU . 16.5 tm0? -58.71 132.79 54.92 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 115.831 -0.622 . . . . 0.0 109.477 179.143 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.9 m -55.05 -37.3 66.55 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 112.613 0.597 . . . . 0.0 112.613 -170.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -84.02 -67.35 0.8 Allowed 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 110.116 -0.327 . . . . 0.0 110.116 179.109 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.404 ' HB3' ' HA ' ' A' ' 78' ' ' GLU . . . 64.06 156.84 0.12 Allowed Pre-proline 0 CA--C 1.539 0.53 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.682 178.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -73.31 -7.29 20.23 Favored 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 122.438 2.092 . . . . 0.0 112.586 -178.616 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.446 ' HG2' ' O ' ' A' ' 77' ' ' LYS . 46.6 tttm -145.28 7.92 1.18 Allowed 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.591 -177.873 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.404 ' HA ' ' HB3' ' A' ' 75' ' ' ALA . 12.3 pt-20 38.4 86.24 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 123.65 0.78 . . . . 0.0 112.266 -174.596 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.425 HG12 ' H ' ' A' ' 81' ' ' LEU . 54.3 t -56.28 132.91 20.47 Favored 'Isoleucine or valine' 0 C--O 1.232 0.16 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.291 -179.376 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 43.9 m-80 -76.25 14.99 0.63 Allowed 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 116.232 -0.44 . . . . 0.0 112.178 -173.31 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.425 ' H ' HG12 ' A' ' 79' ' ' VAL . 57.7 tp -62.22 133.81 55.68 Favored 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 175.537 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -61.36 167.62 3.15 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-O 121.168 0.509 . . . . 0.0 111.785 -176.356 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 92.9 t80 -69.74 -43.97 71.22 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.162 -177.211 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.469 ' O ' HG23 ' A' ' 88' ' ' VAL . 80.6 t60 -58.83 -51.83 68.32 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.446 -174.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 43.7 m -63.7 -42.76 97.93 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.519 -176.001 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 8.0 ptpp? -67.31 -33.03 74.42 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 120.586 -0.445 . . . . 0.0 109.984 179.236 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 17.7 tp10 -61.86 -45.53 93.37 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-O 121.223 0.535 . . . . 0.0 109.898 177.554 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.469 HG23 ' O ' ' A' ' 84' ' ' HIS . 88.2 t -54.86 -43.14 66.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.976 176.583 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 72.4 mt -65.44 -43.76 94.5 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.886 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 39.9 p -63.72 -25.05 68.02 Favored 'General case' 0 CA--C 1.534 0.345 0 N-CA-C 111.683 0.253 . . . . 0.0 111.683 -176.525 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 60.5 m-80 -90.43 -22.94 21.18 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 120.706 0.289 . . . . 0.0 111.16 177.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 29.3 t -100.24 -5.48 27.51 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 116.714 -0.221 . . . . 0.0 111.348 -177.373 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 9.9 tp -62.68 -23.55 33.05 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 CA-C-N 116.683 -0.235 . . . . 0.0 111.608 -175.819 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 6.8 t -58.6 -49.42 77.52 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-O 120.737 0.304 . . . . 0.0 110.88 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 21.6 mt-30 -139.43 81.53 20.26 Favored Pre-proline 0 C--O 1.235 0.316 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 178.352 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -83.1 162.5 15.52 Favored 'Trans proline' 0 CA--C 1.532 0.414 0 C-N-CA 122.834 2.356 . . . . 0.0 112.939 -176.281 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 77.1 p -90.35 174.78 7.39 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.119 174.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 9.2 mp -63.72 -11.86 29.66 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 120.828 0.347 . . . . 0.0 111.507 -178.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . 0.444 ' O ' ' HB2' ' A' ' 102' ' ' ASP . 0.2 OUTLIER -143.64 37.34 1.33 Allowed 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 -178.386 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 22.9 t -57.28 -22.86 44.53 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.969 -176.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.41 ' O ' ' HG3' ' A' ' 105' ' ' GLN . 82.8 m-85 -88.93 15.37 8.62 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.797 0.332 . . . . 0.0 110.616 -179.841 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . 0.544 ' HA ' ' NE2' ' A' ' 105' ' ' GLN . 20.5 t70 -54.67 -53.12 58.97 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.75 -173.768 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.449 ' O ' ' HG2' ' A' ' 107' ' ' ARG . . . -59.98 -37.51 79.84 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 120.993 0.425 . . . . 0.0 111.002 178.807 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.74 -37.73 85.33 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.796 -0.638 . . . . 0.0 111.012 -178.096 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.544 ' NE2' ' HA ' ' A' ' 102' ' ' ASP . 29.4 mt-30 -54.86 -57.02 13.28 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-O 121.286 0.565 . . . . 0.0 109.587 177.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . 0.688 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 20.0 m -55.94 -45.58 78.77 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 114.735 -1.12 . . . . 0.0 110.828 -176.86 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . 0.501 ' O ' ' HG ' ' A' ' 111' ' ' LEU . 39.8 mmt180 -54.08 -57.97 9.08 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.974 0.416 . . . . 0.0 111.004 -179.56 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.562 ' HA ' HD12 ' A' ' 111' ' ' LEU . 46.3 t -63.17 -33.45 60.99 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.566 -178.002 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . 0.546 ' HA ' ' HE1' ' A' ' 112' ' ' MET . 48.3 t80 -59.14 -45.33 91.22 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.762 177.655 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.688 ' HG3' ' O ' ' A' ' 106' ' ' SER . 29.7 mt-30 -61.07 -40.92 95.52 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 121.528 0.68 . . . . 0.0 109.684 178.063 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.562 HD12 ' HA ' ' A' ' 108' ' ' VAL . 94.4 mt -58.04 -54.12 50.5 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.538 -1.21 . . . . 0.0 112.432 -172.296 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . 0.546 ' HE1' ' HA ' ' A' ' 109' ' ' TYR . 0.0 OUTLIER -85.59 -12.38 51.68 Favored 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 119.864 -0.734 . . . . 0.0 110.922 -177.654 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . 0.676 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 38.4 tt0 -63.71 -66.69 0.51 Allowed 'General case' 0 C--O 1.233 0.231 0 N-CA-C 109.43 -0.581 . . . . 0.0 109.43 174.074 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 13.6 pt20 -50.91 -32.32 20.32 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.676 -177.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . 0.565 ' O ' ' HD3' ' A' ' 119' ' ' ARG . 25.1 t70 -97.84 -76.5 0.52 Allowed 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.612 -176.68 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 23.0 t -62.8 -38.18 89.67 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -171.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . 0.676 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 31.0 t80 -64.98 -38.88 92.42 Favored 'General case' 0 N--CA 1.468 0.454 0 O-C-N 122.287 -0.258 . . . . 0.0 111.157 -176.471 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 27.8 p -67.73 -42.03 82.51 Favored 'General case' 0 C--O 1.24 0.568 0 CA-C-O 121.063 0.459 . . . . 0.0 110.541 179.41 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . 0.565 ' HD3' ' O ' ' A' ' 115' ' ' ASP . 10.5 mpt_? -66.54 -34.84 78.79 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.005 176.267 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 86.3 t80 -60.83 -42.27 97.43 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 175.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.429 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 91.3 mt -61.87 -27.82 69.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.607 177.424 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . 0.456 ' HD3' ' HA ' ' A' ' 122' ' ' LYS . 64.0 mmtt -110.03 18.34 20.14 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 112.379 0.511 . . . . 0.0 112.379 179.262 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 80.2 p -79.77 147.72 31.74 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 171.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -55.22 -29.87 58.83 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 121.066 0.46 . . . . 0.0 110.39 176.516 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.451 ' O ' ' HG ' ' A' ' 129' ' ' LEU . 2.1 mp -60.19 -57.72 10.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.482 179.4 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 72.9 t80 -65.52 -39.34 91.71 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.664 -177.486 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.401 HD13 ' HA ' ' A' ' 127' ' ' LEU . 3.8 mm? -63.77 -33.41 75.59 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.854 178.136 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . 0.717 ' HA ' ' HA3' ' A' ' 132' ' ' GLY . 34.9 t70 -67.83 -34.53 76.9 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.065 0.459 . . . . 0.0 110.288 176.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.634 HD13 HG11 ' A' ' 3' ' ' VAL . 73.3 mt -76.41 -17.53 59.3 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.451 178.159 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' MET . . . . . 0.408 ' HE1' HG13 ' A' ' 9' ' ' VAL . 0.0 OUTLIER -91.3 -74.29 0.51 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.829 178.493 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -146.21 34.41 0.99 Allowed 'General case' 0 C--O 1.236 0.361 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.58 -175.75 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . 0.717 ' HA3' ' HA ' ' A' ' 128' ' ' ASP . . . -74.36 -104.7 0.09 OUTLIER Glycine 0 C--N 1.331 0.27 0 C-N-CA 120.993 -0.622 . . . . 0.0 112.296 -179.505 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . 0.471 ' NH2' ' HB2' ' A' ' 128' ' ' ASP . 0.1 OUTLIER -97.67 114.57 65.13 Favored Pre-proline 0 CA--C 1.532 0.28 0 O-C-N 122.761 -0.258 . . . . 0.0 110.388 -179.976 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo . . . . . 0 C--N 1.35 0.621 0 C-N-CA 122.47 2.113 . . . . 0.0 111.708 179.021 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 29.1 m . . . . . 0 N--CA 1.475 0.779 0 N-CA-C 110.835 -0.061 . . . . 0.0 110.835 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 67.9 mtm 64.64 -72.08 0.07 Allowed 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 122.926 0.49 . . . . 0.0 110.014 -173.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.464 HG23 ' HB3' ' A' ' 7' ' ' GLU . 4.0 p -124.38 142.58 40.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.761 175.714 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 16.8 m -104.37 150.94 38.99 Favored Pre-proline 0 C--N 1.325 -0.461 0 CA-C-N 116.245 -0.434 . . . . 0.0 109.938 -179.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.414 ' HA ' ' HB3' ' A' ' 8' ' ' ALA . 1.2 Cg_endo -45.95 -31.78 8.7 Favored 'Trans proline' 0 C--N 1.353 0.797 0 C-N-CA 123.325 2.684 . . . . 0.0 112.667 178.98 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.462 ' O ' ' HD3' ' A' ' 10' ' ' LYS . 9.1 tp10 -55.74 -52.52 63.63 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-O 121.343 0.592 . . . . 0.0 110.144 175.649 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.464 ' HB3' HG23 ' A' ' 3' ' ' VAL . 9.5 tp10 -69.23 -32.67 72.07 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.727 -0.669 . . . . 0.0 109.967 179.04 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.414 ' HB3' ' HA ' ' A' ' 5' ' ' PRO . . . -62.66 -46.64 87.27 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.073 -179.348 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.424 HG22 ' O ' ' A' ' 6' ' ' GLU . 32.2 m -67.83 -27.93 39.63 Favored 'Isoleucine or valine' 0 C--O 1.235 0.313 0 CA-C-O 120.824 0.345 . . . . 0.0 110.198 179.167 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.462 ' HD3' ' O ' ' A' ' 6' ' ' GLU . 13.9 mptt -69.25 -36.52 77.25 Favored 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.027 173.244 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.406 ' HB2' ' O ' ' A' ' 8' ' ' ALA . 49.7 m0 -60.83 -36.82 80.08 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 109.374 -0.602 . . . . 0.0 109.374 172.05 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -70.58 2.26 16.99 Favored Glycine 0 CA--C 1.521 0.418 0 CA-C-N 114.91 -1.041 . . . . 0.0 113.711 -177.063 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.407 ' HG3' ' O ' ' A' ' 10' ' ' LYS . 2.8 pp20? -127.74 -3.09 5.96 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 117.394 0.597 . . . . 0.0 111.499 177.326 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 74.0 m -153.34 105.78 2.89 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 120.667 0.27 . . . . 0.0 111.005 177.781 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.42 ' O ' ' HB3' ' A' ' 18' ' ' LEU . 30.9 t80 -58.33 -36.77 73.9 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 121.031 0.443 . . . . 0.0 109.932 178.292 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -57.43 -45.41 84.7 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.03 176.48 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.413 ' HB2' ' HE3' ' A' ' 17' ' ' LYS . 37.5 ttmt -65.07 -36.47 84.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.752 -0.658 . . . . 0.0 109.975 -178.513 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.42 ' HB3' ' O ' ' A' ' 15' ' ' PHE . 36.0 tp -59.73 -51.49 69.54 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.671 175.305 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 21.4 tp -80.49 -24.05 39.72 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.786 -171.704 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 70.7 m -69.57 -27.02 64.77 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.072 0.463 . . . . 0.0 110.629 178.11 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -80.15 129.73 34.71 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.568 174.067 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 10.6 tpt180 -59.47 -32.99 70.76 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 174.4 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -57.57 -50.82 71.85 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.476 -0.784 . . . . 0.0 109.536 176.655 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -70.78 -41.3 63.62 Favored Glycine 0 N--CA 1.449 -0.46 0 CA-C-N 115.014 -0.993 . . . . 0.0 112.217 -177.595 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 9.6 tt -60.21 -47.34 86.38 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 122.783 0.433 . . . . 0.0 110.226 179.572 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.61 ' O ' ' HG2' ' A' ' 30' ' ' ARG . 9.3 tp10 -65.09 -49.35 70.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.827 -179.339 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -59.74 -42.11 92.42 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.071 -179.646 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 76.9 t80 -68.64 -48.38 64.19 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.059 -176.449 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.422 HG22 ' O ' ' A' ' 26' ' ' GLU . 14.6 t -60.53 -36.01 77.36 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 120.695 0.283 . . . . 0.0 110.544 -177.403 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.61 ' HG2' ' O ' ' A' ' 26' ' ' GLU . 21.6 mmt180 -62.53 -52.8 62.01 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.025 0.441 . . . . 0.0 110.326 178.735 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.571 ' O ' HG22 ' A' ' 34' ' ' THR . 84.5 t80 -65.31 -31.03 71.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.609 179.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 17.7 tp -74.03 -26.77 60.61 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.435 -179.199 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.412 ' HG3' ' O ' ' A' ' 29' ' ' THR . 67.3 mttm -76.95 -34.77 57.59 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.26 178.839 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.571 HG22 ' O ' ' A' ' 31' ' ' PHE . 7.2 t -71.17 -8.52 54.05 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 120.785 0.326 . . . . 0.0 111.095 -177.013 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -119.24 17.34 13.13 Favored 'General case' 0 N--CA 1.464 0.24 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 173.142 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 33.4 p90 43.41 29.94 0.28 Allowed 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.171 0.988 . . . . 0.0 112.822 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 31.5 m -95.63 8.88 42.13 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.184 176.375 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -56.8 -21.06 25.93 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.066 -179.205 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.435 ' HG3' ' N ' ' A' ' 40' ' ' ASN . 8.9 pt-20 -49.62 -37.24 27.21 Favored 'General case' 0 C--O 1.225 -0.216 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.271 177.628 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.435 ' N ' ' HG3' ' A' ' 39' ' ' GLU . 46.9 m-80 -60.77 -61.31 2.68 Favored 'General case' 0 C--O 1.24 0.605 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.803 -174.215 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 13.0 tt -64.47 -34.02 66.75 Favored 'Isoleucine or valine' 0 C--O 1.235 0.309 0 CA-C-O 121.053 0.454 . . . . 0.0 110.019 -177.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.454 ' O ' HG22 ' A' ' 45' ' ' ILE . 6.3 tp10 -72.74 -25.94 61.39 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.166 -179.309 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.435 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 71.9 t80 -64.63 -65.1 0.72 Allowed 'General case' 0 C--O 1.236 0.384 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.713 179.136 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . . . . . . . . . 32.6 p-90 -78.08 -9.72 59.28 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 119.747 -0.781 . . . . 0.0 112.385 -173.364 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.614 ' O ' ' HG3' ' A' ' 48' ' ' GLU . 9.5 tt -75.17 -31.54 24.76 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.201 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 169.502 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.28 -29.31 69.51 Favored 'General case' 0 C--O 1.232 0.137 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 172.472 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.575 ' SG ' ' HB2' ' A' ' 101' ' ' PHE . 52.7 t -66.22 -32.73 74.33 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.349 176.309 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.614 ' HG3' ' O ' ' A' ' 45' ' ' ILE . 0.0 OUTLIER -82.91 -28.79 29.69 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 177.379 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.441 ' O ' ' HB2' ' A' ' 52' ' ' LYS . 15.6 t70 -58.41 -27.61 64.45 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.742 0.782 . . . . 0.0 109.094 167.386 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.502 ' HB3' ' O ' ' A' ' 47' ' ' CYS . 42.4 t80 -79.3 -30.11 42.75 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 114.87 -1.059 . . . . 0.0 111.211 175.416 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.606 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 10.0 ptmt -60.74 -22.79 64.38 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 174.792 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.441 ' HB2' ' O ' ' A' ' 49' ' ' ASP . 14.0 mptt -72.47 56.79 0.37 Allowed 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.311 168.661 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.405 ' HB2' ' HD3' ' A' ' 62' ' ' LYS . 48.1 t -141.7 94.04 2.63 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.939 0.4 . . . . 0.0 109.939 175.159 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.63 -6.88 59.56 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.836 -179.757 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -106.8 123.19 7.24 Favored Glycine 0 CA--C 1.519 0.302 0 CA-C-O 119.735 -0.48 . . . . 0.0 111.916 -179.597 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_exo -56.39 -26.56 63.28 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.721 2.28 . . . . 0.0 112.507 179.714 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 30.5 mm-40 -71.49 -45.46 62.45 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 174.458 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 75.3 mm-40 -59.23 -31.75 69.35 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.06 179.342 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.4 HG23 ' HZ ' ' A' ' 50' ' ' PHE . 37.2 mm -50.9 -54.43 10.26 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.115 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.614 176.099 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 37.5 m-70 -65.86 -36.5 83.62 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.84 -177.67 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 83.4 mt -68.73 -51.77 37.8 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.458 -176.459 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.405 ' HD3' ' HB2' ' A' ' 53' ' ' SER . 52.2 mtpt -71.39 -31.45 67.3 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.413 -177.65 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.72 -42.01 87.01 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 120.968 0.413 . . . . 0.0 110.06 174.415 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 22.5 tptp -59.52 -35.2 73.72 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.097 176.431 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -65.03 -57.2 9.27 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.584 176.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 65.3 mt -58.64 -33.33 48.43 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 CA-C-O 121.204 0.526 . . . . 0.0 110.337 179.209 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.538 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 50.5 t80 -55.86 -61.9 2.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.449 177.426 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -71.25 -31.27 67.33 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.728 -174.732 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -82.79 -25.4 32.79 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.755 -174.491 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 85.7 m-85 -133.56 -53.74 0.88 Allowed 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -174.608 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.538 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 50.0 mm -70.72 -29.54 38.39 Favored 'Isoleucine or valine' 0 C--O 1.238 0.492 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 -170.471 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -64.63 143.29 58.03 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.018 -173.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 18.8 m -63.19 -39.56 95.0 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.06 178.263 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -101.24 92.51 5.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.538 0.685 . . . . 0.0 109.708 172.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.503 ' HB3' ' HA ' ' A' ' 78' ' ' GLU . . . -123.27 161.33 45.82 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.2 -176.312 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.502 ' HD2' ' HB1' ' A' ' 75' ' ' ALA . 4.1 Cg_endo -45.63 -37.37 15.49 Favored 'Trans proline' 0 C--N 1.356 0.958 0 C-N-CA 123.451 2.767 . . . . 0.0 113.02 -178.143 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.41 ' HE2' ' HB3' ' A' ' 39' ' ' GLU . 8.7 ttpp -139.93 -3.43 1.43 Allowed 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.615 -0.266 . . . . 0.0 111.081 176.6 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.503 ' HA ' ' HB3' ' A' ' 75' ' ' ALA . 54.8 mt-10 60.94 157.27 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 121.457 0.646 . . . . 0.0 111.92 -176.138 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 68.0 t -119.94 144.84 27.34 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 CA-C-N 115.566 -0.743 . . . . 0.0 109.494 175.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 39.1 m-80 -81.59 19.93 0.97 Allowed 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 111.981 0.363 . . . . 0.0 111.981 -176.109 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 28.0 tp -65.77 140.39 58.42 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 109.711 -0.477 . . . . 0.0 109.711 175.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.408 ' OD2' ' HB3' ' A' ' 84' ' ' HIS . 8.4 p-10 -64.29 156.66 28.26 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.139 0.495 . . . . 0.0 112.098 -171.749 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.422 ' HA ' ' HG2' ' A' ' 86' ' ' LYS . 96.8 m-85 -60.07 -40.43 89.47 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 115.33 -0.85 . . . . 0.0 111.059 -178.514 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.467 ' O ' HG23 ' A' ' 88' ' ' VAL . 24.0 t60 -53.61 -56.3 18.34 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.314 -179.175 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.438 ' OG1' ' HG3' ' A' ' 107' ' ' ARG . 29.2 m -72.06 -42.41 66.27 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.856 -174.588 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.422 ' HG2' ' HA ' ' A' ' 83' ' ' PHE . 0.1 OUTLIER -65.76 -31.85 73.07 Favored 'General case' 0 N--CA 1.463 0.181 0 C-N-CA 120.753 -0.379 . . . . 0.0 110.203 -178.985 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -62.54 -47.93 81.73 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.328 0.585 . . . . 0.0 109.947 177.242 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.467 HG23 ' O ' ' A' ' 84' ' ' HIS . 98.1 t -53.7 -46.3 61.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.554 178.687 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 56.9 mt -72.42 -40.9 64.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.535 -176.566 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 22.0 p -62.87 -21.67 66.14 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.788 0.327 . . . . 0.0 111.25 -178.372 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 35.4 m-80 -96.46 -38.6 9.95 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.094 176.146 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 16.8 t -83.35 0.06 47.6 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.596 -0.274 . . . . 0.0 111.468 -175.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 8.0 tp -57.38 -26.59 26.59 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 CA-C-O 120.866 0.365 . . . . 0.0 111.628 -178.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.422 HG23 ' HG2' ' A' ' 95' ' ' GLN . 9.9 t -66.45 -28.2 68.42 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 120.978 0.418 . . . . 0.0 110.984 179.313 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.422 ' HG2' HG23 ' A' ' 94' ' ' THR . 22.7 pt20 -139.21 71.45 40.01 Favored Pre-proline 0 CA--C 1.534 0.355 0 CA-C-O 121.129 0.49 . . . . 0.0 110.548 -178.736 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -87.6 131.78 2.91 Favored 'Trans proline' 0 N--CA 1.459 -0.523 0 C-N-CA 122.735 2.29 . . . . 0.0 112.477 -178.886 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.471 ' N ' ' HB2' ' A' ' 100' ' ' SER . 37.9 p -83.52 171.77 13.04 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.411 174.59 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 36.9 tp -61.02 -26.03 67.32 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 121.266 0.555 . . . . 0.0 110.526 -178.791 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . 0.568 ' HB3' ' HB2' ' A' ' 102' ' ' ASP . 23.3 m-70 -119.74 34.37 5.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.522 177.171 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . 0.471 ' HB2' ' N ' ' A' ' 97' ' ' THR . 22.2 t -61.74 -31.81 72.01 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.32 177.337 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.575 ' HB2' ' SG ' ' A' ' 47' ' ' CYS . 88.0 m-85 -91.9 6.36 46.5 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.966 -178.77 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . 0.568 ' HB2' ' HB3' ' A' ' 99' ' ' HIS . 12.8 t70 -64.11 -41.65 97.17 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.117 0.484 . . . . 0.0 110.347 -177.178 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.445 ' O ' ' HG2' ' A' ' 107' ' ' ARG . . . -59.32 -43.3 92.68 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.179 176.254 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -66.0 -37.41 85.84 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.413 177.778 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 21.5 tm0? -57.86 -45.38 86.4 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.169 176.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . 0.674 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 47.7 t -60.15 -58.44 8.53 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 115.527 -0.761 . . . . 0.0 110.165 176.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . 0.446 ' O ' ' HG ' ' A' ' 111' ' ' LEU . 23.2 mmm180 -49.22 -55.42 12.62 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-O 120.945 0.402 . . . . 0.0 111.336 -177.864 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 74.6 t -57.44 -40.03 72.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.026 179.444 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . 0.514 ' HA ' ' HE2' ' A' ' 112' ' ' MET . 55.6 t80 -64.26 -37.35 87.16 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.772 178.714 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.674 ' HG3' ' O ' ' A' ' 106' ' ' SER . 42.7 mt-30 -67.56 -42.1 83.15 Favored 'General case' 0 N--CA 1.468 0.434 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 178.24 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.446 ' HG ' ' O ' ' A' ' 107' ' ' ARG . 93.4 mt -59.71 -45.02 93.42 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 114.819 -1.082 . . . . 0.0 110.679 -179.171 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . 0.514 ' HE2' ' HA ' ' A' ' 109' ' ' TYR . 54.5 mtm -62.08 -41.34 98.07 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 176.811 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . 0.634 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 4.5 tm-20 -61.92 -71.03 0.16 Allowed 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.913 -176.169 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -57.69 -18.13 19.01 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -171.487 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . 0.468 ' O ' ' HD3' ' A' ' 119' ' ' ARG . 7.8 m-20 -118.26 -75.99 0.58 Allowed 'General case' 0 N--CA 1.463 0.201 0 N-CA-C 111.576 0.213 . . . . 0.0 111.576 179.075 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 17.6 m -58.56 -28.37 65.46 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -171.641 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . 0.634 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 68.4 t80 -78.11 -45.32 23.71 Favored 'General case' 0 C--N 1.333 -0.123 0 N-CA-C 110.694 -0.113 . . . . 0.0 110.694 -176.825 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . 0.55 HG23 ' HD2' ' A' ' 119' ' ' ARG . 11.5 t -66.62 -40.22 88.68 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-O 120.918 0.389 . . . . 0.0 110.151 178.294 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . 0.55 ' HD2' HG23 ' A' ' 118' ' ' THR . 3.1 mpt_? -61.53 -38.66 88.22 Favored 'General case' 0 N--CA 1.461 0.104 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 173.754 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.48 ' HA ' ' HB3' ' A' ' 123' ' ' SER . 76.8 t80 -64.7 -36.16 83.39 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.322 177.38 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.481 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 89.9 mt -59.76 -28.99 67.87 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.646 0.26 . . . . 0.0 110.576 178.035 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . 0.451 ' HD3' ' HA ' ' A' ' 122' ' ' LYS . 31.1 mmtp -115.1 16.9 16.97 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 176.121 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . 0.48 ' HB3' ' HA ' ' A' ' 120' ' ' PHE . 83.6 p -70.42 141.48 52.12 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 173.408 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -55.88 -38.14 69.75 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.243 -178.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.476 ' O ' ' HG ' ' A' ' 129' ' ' LEU . 7.7 tp -65.09 -42.86 95.54 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.147 -179.318 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 73.6 t80 -69.62 -36.97 76.64 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.743 0.306 . . . . 0.0 110.684 -179.609 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 94.4 mt -66.39 -29.88 70.14 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-O 120.934 0.397 . . . . 0.0 110.019 177.3 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -65.53 -34.05 77.35 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.048 173.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.476 ' HG ' ' O ' ' A' ' 125' ' ' ILE . 55.2 mt -76.3 -29.95 57.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.592 177.325 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' MET . . . . . . . . . . . . . 4.7 mmt -63.82 -21.52 66.47 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 116.094 -0.503 . . . . 0.0 112.128 -179.451 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -97.15 -3.58 40.79 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.738 0.304 . . . . 0.0 110.628 178.573 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 59.58 59.58 10.32 Favored Glycine 0 C--N 1.334 0.433 0 N-CA-C 111.393 -0.683 . . . . 0.0 111.393 -176.567 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . 0.413 HH11 ' HD2' ' A' ' 133' ' ' ARG . 21.1 ttt180 -43.87 115.55 2.11 Favored Pre-proline 0 C--O 1.238 0.483 0 C-N-CA 123.265 0.626 . . . . 0.0 112.393 -174.876 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo . . . . . 0 C--N 1.349 0.578 0 C-N-CA 122.523 2.148 . . . . 0.0 111.257 176.371 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 28.7 t . . . . . 0 N--CA 1.478 0.953 0 N-CA-C 110.133 -0.321 . . . . 0.0 110.133 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 15.6 tpt 61.61 89.94 0.07 Allowed 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.464 0.65 . . . . 0.0 110.213 -175.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.451 HG11 ' CH2' ' A' ' 11' ' ' TRP . 8.6 p -78.19 160.78 4.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.494 -174.101 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.408 ' N ' HG22 ' A' ' 3' ' ' VAL . 36.9 m -66.06 132.06 94.56 Favored Pre-proline 0 CA--C 1.534 0.363 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.889 172.602 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_exo -49.14 -33.98 29.06 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 123.159 2.573 . . . . 0.0 113.433 -176.012 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.509 ' O ' ' HG2' ' A' ' 10' ' ' LYS . 42.1 mt-10 -61.76 -45.61 93.17 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-O 120.809 0.337 . . . . 0.0 110.803 -179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.407 ' O ' ' HB2' ' A' ' 10' ' ' LYS . 17.4 tp10 -70.22 -33.38 71.6 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.155 0.502 . . . . 0.0 109.7 177.814 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.21 -45.5 92.98 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.804 179.124 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 30.7 m -75.02 -19.06 16.28 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-O 120.758 0.313 . . . . 0.0 110.837 179.486 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.509 ' HG2' ' O ' ' A' ' 6' ' ' GLU . 72.0 mmtt -67.06 -29.1 68.79 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.513 173.274 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.451 ' CH2' HG11 ' A' ' 3' ' ' VAL . 54.2 m0 -62.08 -24.11 66.91 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.503 -0.317 . . . . 0.0 111.074 -179.28 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -65.59 -12.07 55.26 Favored Glycine 0 CA--C 1.521 0.424 0 C-N-CA 121.173 -0.537 . . . . 0.0 112.593 177.325 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -74.71 -49.67 20.31 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-O 120.718 0.294 . . . . 0.0 110.611 177.866 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 30.5 m -154.19 128.76 9.26 Favored 'General case' 0 C--O 1.24 0.575 0 CA-C-O 121.024 0.44 . . . . 0.0 111.639 -175.127 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.454 ' CD1' HD23 ' A' ' 18' ' ' LEU . 84.8 t80 -55.55 -26.84 45.55 Favored 'General case' 0 N--CA 1.461 0.111 0 CA-C-N 115.641 -0.708 . . . . 0.0 109.931 175.141 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -51.89 -55.39 20.43 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.377 -0.828 . . . . 0.0 111.168 177.243 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.485 ' HD2' ' O ' ' A' ' 10' ' ' LYS . 17.3 ptpt -71.94 -30.42 65.3 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 120.927 -0.309 . . . . 0.0 110.363 -176.616 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.454 HD23 ' CD1' ' A' ' 15' ' ' PHE . 51.6 tp -56.32 -51.93 66.43 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.068 -0.514 . . . . 0.0 109.98 175.052 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 51.4 tp -71.19 -35.26 71.51 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.86 -178.138 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 48.0 m -74.3 -22.26 59.36 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.878 -177.103 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 3.9 t-80 -90.61 117.66 29.45 Favored 'General case' 0 N--CA 1.462 0.134 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 -179.641 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.539 ' HD3' ' H ' ' A' ' 22' ' ' ARG . 0.0 OUTLIER -36.68 -53.46 0.9 Allowed 'General case' 0 N--CA 1.475 0.817 0 O-C-N 123.847 0.717 . . . . 0.0 111.852 -176.682 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -56.93 -45.36 82.8 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.77 -177.454 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -65.95 -44.64 91.31 Favored Glycine 0 C--N 1.333 0.372 0 CA-C-N 115.727 -0.669 . . . . 0.0 111.791 -179.198 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 8.0 tt -57.9 -44.84 87.03 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.888 0.375 . . . . 0.0 110.299 177.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 31.9 tt0 -64.33 -46.43 83.54 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.555 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -63.76 -35.41 80.49 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 120.999 0.428 . . . . 0.0 110.504 179.597 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -71.0 -49.51 44.45 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.419 -0.809 . . . . 0.0 110.956 -176.393 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 9.1 t -62.86 -36.12 82.24 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 120.656 0.265 . . . . 0.0 110.704 -178.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 74.6 mtm180 -64.92 -38.94 92.63 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 120.731 0.3 . . . . 0.0 111.104 179.661 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.583 ' O ' HG22 ' A' ' 34' ' ' THR . 87.0 t80 -76.55 -50.69 13.3 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.055 0.455 . . . . 0.0 110.553 178.789 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 36.8 tp -58.36 -24.95 61.37 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.011 -178.495 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 24.0 ttmm -63.75 -33.22 75.16 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.599 -178.665 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.583 HG22 ' O ' ' A' ' 31' ' ' PHE . 6.2 t -68.82 -20.51 64.31 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 121.183 -0.207 . . . . 0.0 111.457 -174.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -105.03 -1.5 25.61 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.806 0.336 . . . . 0.0 110.463 177.755 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 61.62 18.99 10.05 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 115.734 -0.666 . . . . 0.0 112.306 175.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 19.3 m -84.05 2.92 36.9 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 121.077 0.465 . . . . 0.0 109.955 176.157 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -51.65 -21.99 3.07 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 115.252 -0.886 . . . . 0.0 112.709 -177.46 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -58.61 -17.27 20.69 Favored 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 -176.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.461 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 20.7 p30 -67.78 -39.44 84.08 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-O 121.269 0.557 . . . . 0.0 110.044 175.329 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.461 ' HA ' ' CZ2' ' A' ' 44' ' ' TRP . 58.6 mt -65.53 -47.34 86.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.68 175.406 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.538 ' HA ' HG22 ' A' ' 45' ' ' ILE . 2.8 mp0 -64.51 -24.0 67.46 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.931 176.239 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.461 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 60.3 t80 -61.58 -62.91 1.48 Allowed 'General case' 0 C--O 1.237 0.445 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.464 179.728 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.461 ' CZ2' ' HA ' ' A' ' 41' ' ' ILE . 3.6 p-90 -82.78 -7.81 59.63 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 120.292 -0.563 . . . . 0.0 112.422 -177.678 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.538 HG22 ' HA ' ' A' ' 42' ' ' GLU . 5.5 tt -76.9 -30.37 18.2 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 171.377 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -71.25 -35.5 71.43 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.735 173.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.415 ' O ' ' HB3' ' A' ' 50' ' ' PHE . 71.3 m -63.88 -33.74 76.38 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.12 174.524 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.614 ' O ' ' HG3' ' A' ' 52' ' ' LYS . 3.5 tm-20 -63.59 -51.24 66.19 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 108.434 -0.951 . . . . 0.0 108.434 173.109 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.553 ' HA ' ' CD ' ' A' ' 52' ' ' LYS . 27.5 t70 -50.36 -31.98 16.12 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.601 176.447 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.415 ' HB3' ' O ' ' A' ' 47' ' ' CYS . 78.9 t80 -70.51 -43.82 68.87 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.548 -178.578 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.575 ' HE3' ' HG2' ' A' ' 48' ' ' GLU . 18.6 pttp -69.13 -16.58 63.69 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 120.89 0.376 . . . . 0.0 110.823 -177.502 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.614 ' HG3' ' O ' ' A' ' 48' ' ' GLU . 15.8 mtpp -75.78 -14.02 60.3 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.256 178.739 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 79.4 p -58.22 -47.83 82.27 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.254 -175.669 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 46.91 18.57 0.07 Allowed 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.285 1.034 . . . . 0.0 112.769 -179.413 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . 0.469 ' O ' HG12 ' A' ' 59' ' ' ILE . . . -129.89 123.34 4.02 Favored Glycine 0 C--N 1.331 0.251 0 N-CA-C 111.313 -0.715 . . . . 0.0 111.313 -179.121 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.402 ' O ' ' HB ' ' A' ' 59' ' ' ILE . 9.8 Cg_endo -48.9 -52.16 9.18 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 123.378 2.719 . . . . 0.0 112.851 -173.758 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 27.2 pt20 -63.17 -39.46 94.71 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 120.717 0.294 . . . . 0.0 111.085 -179.214 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -68.47 -26.51 65.52 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.395 -178.317 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.469 HG12 ' O ' ' A' ' 55' ' ' GLY . 38.4 mm -55.91 -49.81 72.78 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.213 0 CA-C-O 121.07 0.462 . . . . 0.0 110.169 175.36 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 63.4 m-70 -64.92 -35.29 80.69 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.375 -177.409 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 93.8 mt -73.13 -54.32 8.79 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.518 -176.364 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 32.4 mmtp -63.74 -35.67 81.36 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 120.539 0.209 . . . . 0.0 110.785 -179.459 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.47 -48.82 80.1 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.189 176.499 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 17.9 tppt? -57.26 -40.42 77.66 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.611 177.266 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -59.53 -64.05 1.08 Allowed 'General case' 0 C--O 1.234 0.238 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.795 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 64.7 mt -56.39 -36.82 48.32 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 CA-C-O 121.14 0.495 . . . . 0.0 110.542 -179.463 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.481 ' CE1' HG22 ' A' ' 90' ' ' THR . 8.3 t80 -54.55 -73.94 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.348 -179.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.405 ' HG3' ' CD2' ' A' ' 67' ' ' TYR . 52.7 mt-10 -75.68 -3.55 35.28 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 -172.686 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 14.5 tppt? -95.18 -34.89 12.08 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 120.981 -0.288 . . . . 0.0 110.677 177.654 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 72.8 m-85 -130.93 -52.74 1.05 Allowed 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 112.05 0.389 . . . . 0.0 112.05 -173.723 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.464 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 46.4 mm -61.0 -44.19 97.69 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 CA-C-O 121.146 0.498 . . . . 0.0 111.388 -171.883 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -69.12 135.35 50.59 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.606 -175.032 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 22.1 m -70.11 -31.88 69.64 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.541 0.686 . . . . 0.0 109.353 176.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -83.74 13.26 4.9 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.151 -0.931 . . . . 0.0 110.816 176.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.559 ' HB1' ' HD2' ' A' ' 76' ' ' PRO . . . -63.76 160.21 47.13 Favored Pre-proline 0 CA--C 1.532 0.286 0 CA-C-N 116.394 -0.367 . . . . 0.0 110.133 176.118 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . 0.559 ' HD2' ' HB1' ' A' ' 75' ' ' ALA . 8.7 Cg_endo -50.27 -30.07 25.09 Favored 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 123.005 2.47 . . . . 0.0 113.164 -174.935 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.508 ' HD2' ' O ' ' A' ' 78' ' ' GLU . 0.1 OUTLIER -146.1 8.47 1.08 Allowed 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 120.639 0.257 . . . . 0.0 111.155 177.781 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.556 ' HA ' ' HB3' ' A' ' 75' ' ' ALA . 9.8 pt-20 45.01 -172.98 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.962 0 C-N-CA 124.715 1.206 . . . . 0.0 114.022 -179.871 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 54.3 t -153.99 139.54 11.02 Favored 'Isoleucine or valine' 0 C--O 1.237 0.408 0 CA-C-N 114.812 -1.086 . . . . 0.0 108.173 178.203 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 -70.39 88.04 0.64 Allowed 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.637 0.732 . . . . 0.0 111.082 -179.074 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 14.0 tp -133.91 145.0 49.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 114.751 -1.113 . . . . 0.0 109.175 178.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -54.12 142.15 26.47 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 121.299 0.571 . . . . 0.0 112.256 -176.168 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 40.8 p90 -66.5 -43.51 85.13 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.109 -0.95 . . . . 0.0 111.789 -176.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.421 ' O ' ' HB3' ' A' ' 87' ' ' GLU . 85.2 t60 -70.37 -30.41 67.33 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.109 0.481 . . . . 0.0 110.461 -175.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 47.3 m -64.82 -52.15 58.28 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.703 -0.681 . . . . 0.0 110.285 177.666 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.475 ' O ' HG23 ' A' ' 90' ' ' THR . 18.0 ptpt -70.64 -24.04 62.64 Favored 'General case' 0 C--O 1.226 -0.164 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.623 -178.697 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.421 ' HB3' ' O ' ' A' ' 84' ' ' HIS . 12.0 tp10 -54.17 -58.73 6.24 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-O 121.448 0.642 . . . . 0.0 110.014 173.406 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 61.4 t -56.09 -42.26 71.81 Favored 'Isoleucine or valine' 0 C--O 1.237 0.44 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.303 178.458 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.403 HG21 HG21 ' A' ' 71' ' ' ILE . 70.1 mt -60.71 -47.36 93.4 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.248 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.207 -179.231 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.481 HG22 ' CE1' ' A' ' 67' ' ' TYR . 60.3 p -59.57 -30.56 68.73 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 121.037 0.446 . . . . 0.0 110.8 -177.599 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 85.2 m-20 -87.01 -17.29 33.34 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 115.817 -0.629 . . . . 0.0 112.26 -175.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 43.3 p -121.66 3.6 10.11 Favored 'General case' 0 N--CA 1.468 0.475 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 -179.745 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.6 tp -61.53 -23.51 30.93 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 CA-C-O 120.776 0.322 . . . . 0.0 111.631 -175.79 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.416 HG23 ' HG3' ' A' ' 95' ' ' GLN . 9.7 t -67.28 -32.97 74.32 Favored 'General case' 0 CA--C 1.533 0.314 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.131 -178.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.416 ' HG3' HG23 ' A' ' 94' ' ' THR . 96.4 mt-30 -136.33 75.58 52.04 Favored Pre-proline 0 N--CA 1.464 0.274 0 N-CA-C 110.321 -0.251 . . . . 0.0 110.321 -178.603 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -92.76 176.45 1.62 Allowed 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 122.82 2.346 . . . . 0.0 112.713 179.13 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 75.4 p -117.31 178.28 4.43 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.426 175.519 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -57.19 -24.94 57.89 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 112.154 0.427 . . . . 0.0 112.154 -173.36 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 93.8 m-70 -138.93 31.17 2.22 Favored 'General case' 0 N--CA 1.466 0.343 0 N-CA-C 112.365 0.506 . . . . 0.0 112.365 -177.024 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 66.0 m -62.08 -21.57 65.06 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 121.078 0.465 . . . . 0.0 110.941 175.221 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -81.82 8.2 10.83 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.374 -179.676 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -60.79 -37.99 83.8 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 120.629 0.252 . . . . 0.0 110.479 -177.664 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.45 -43.23 99.22 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.661 177.499 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -65.34 -46.54 79.82 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.507 179.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.443 ' HG2' ' HB3' ' A' ' 44' ' ' TRP . 46.4 mt-30 -60.29 -41.81 94.16 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.007 177.719 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . 0.675 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 45.7 t -55.82 -58.49 7.64 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.851 178.238 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 2.5 mmp_? -46.98 -59.05 3.37 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.584 -178.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.541 ' O ' ' HG3' ' A' ' 112' ' ' MET . 11.4 p -64.7 -33.35 62.7 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.433 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.552 -175.862 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 15.8 t80 -66.5 -43.54 85.02 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 116.56 -0.291 . . . . 0.0 111.2 -179.521 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.675 ' HG3' ' O ' ' A' ' 106' ' ' SER . 31.1 mt-30 -62.7 -40.3 96.72 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 121.666 0.746 . . . . 0.0 109.014 177.599 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 89.7 mt -60.63 -41.0 94.01 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.531 -1.213 . . . . 0.0 110.415 176.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . 0.541 ' HG3' ' O ' ' A' ' 108' ' ' VAL . 46.2 mtm -60.87 -39.66 90.01 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 109.962 -0.384 . . . . 0.0 109.962 177.338 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . 0.593 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 43.9 tt0 -61.42 -65.97 0.61 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.918 0.39 . . . . 0.0 110.208 179.104 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . 0.412 ' HG2' ' O ' ' A' ' 110' ' ' GLN . 10.7 pt20 -75.07 16.0 0.36 Allowed 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -172.843 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -141.99 -65.44 0.42 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.724 0.297 . . . . 0.0 110.686 173.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 4.2 m -68.21 -38.35 81.82 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.391 -176.351 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . 0.593 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 36.1 t80 -71.51 -40.83 69.88 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 110.285 -0.265 . . . . 0.0 110.285 -175.027 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 29.4 p -63.39 -43.56 97.23 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 120.921 0.391 . . . . 0.0 110.239 177.678 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 69.0 mtp85 -60.0 -40.49 89.4 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.003 174.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 58.3 t80 -66.58 -34.15 77.26 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.204 179.243 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 95.6 mt -65.27 -26.3 68.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.949 0.404 . . . . 0.0 110.249 175.562 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . 0.631 ' HA ' ' HE2' ' A' ' 122' ' ' LYS . 11.4 mmpt? -88.58 -16.44 32.52 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.335 179.263 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 59.1 p -61.66 139.9 58.24 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 120.99 0.424 . . . . 0.0 111.198 -177.161 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 16.6 p-10 -62.37 -31.31 71.95 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.814 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -64.43 -45.26 96.35 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-N 116.24 -0.437 . . . . 0.0 110.393 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' TYR . . . . . 0.451 ' O ' ' HG2' ' A' ' 130' ' ' MET . 69.5 t80 -69.12 -43.18 74.95 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 120.786 0.326 . . . . 0.0 110.333 -179.488 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 99.4 mt -60.42 -35.99 77.11 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.496 178.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -63.72 -38.99 93.2 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.347 177.215 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 91.8 mt -70.54 -27.52 64.22 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.863 -0.608 . . . . 0.0 110.986 179.263 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' MET . . . . . 0.451 ' HG2' ' O ' ' A' ' 126' ' ' TYR . 30.1 mmt -64.65 -63.51 1.11 Allowed 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.223 179.113 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 55.54 21.84 4.72 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.047 177.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 65.48 17.66 64.63 Favored Glycine 0 C--N 1.336 0.566 0 CA-C-N 116.061 -0.518 . . . . 0.0 113.201 -179.776 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 27.1 mmt180 -71.7 140.75 84.27 Favored Pre-proline 0 CA--C 1.533 0.295 0 CA-C-O 120.472 0.177 . . . . 0.0 110.852 -178.644 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo . . . . . 0 C--N 1.349 0.557 0 C-N-CA 122.766 2.311 . . . . 0.0 112.262 177.74 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 22.5 m . . . . . 0 N--CA 1.475 0.817 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 71.5 mtp 66.17 -176.01 0.19 Allowed 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.566 -177.403 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.46 HG11 HD22 ' A' ' 129' ' ' LEU . 7.0 p -55.3 150.1 2.44 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 CA-C-N 115.179 -0.919 . . . . 0.0 112.749 -178.132 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.426 ' H ' ' HB3' ' A' ' 7' ' ' GLU . 32.2 t -133.66 150.28 74.38 Favored Pre-proline 0 CA--C 1.534 0.351 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 173.686 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_exo -43.38 -40.74 10.05 Favored 'Trans proline' 0 C--N 1.351 0.662 0 C-N-CA 122.905 2.404 . . . . 0.0 113.018 179.87 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.536 ' O ' HG22 ' A' ' 9' ' ' VAL . 37.6 tt0 -66.81 -39.55 87.76 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 121.146 0.498 . . . . 0.0 110.453 178.744 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.426 ' HB3' ' H ' ' A' ' 4' ' ' SER . 18.3 tp10 -63.04 -35.84 81.57 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.232 0.539 . . . . 0.0 109.557 177.267 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.88 -45.2 93.66 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.553 -0.748 . . . . 0.0 111.346 -178.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.536 HG22 ' O ' ' A' ' 6' ' ' GLU . 24.6 m -67.56 -26.41 35.47 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.293 0 CA-C-O 120.765 0.317 . . . . 0.0 110.589 179.877 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.523 ' HG2' ' O ' ' A' ' 6' ' ' GLU . 74.3 mmtt -65.95 -29.5 69.92 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.263 0.554 . . . . 0.0 110.145 174.692 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 36.4 m0 -79.07 -30.07 43.75 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 174.321 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -69.64 -11.46 65.6 Favored Glycine 0 C--N 1.332 0.354 0 CA-C-N 115.286 -0.87 . . . . 0.0 112.65 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -106.83 -36.3 6.7 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-O 120.705 0.288 . . . . 0.0 110.778 175.547 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 46.4 t -123.85 105.5 9.69 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 120.905 0.383 . . . . 0.0 111.081 -176.184 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.409 ' O ' HD13 ' A' ' 19' ' ' LEU . 30.1 t80 -61.67 -33.64 74.34 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.995 177.391 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -61.15 -40.9 95.57 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.389 175.365 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.54 ' HB2' ' NZ ' ' A' ' 17' ' ' LYS . 4.1 ttmp? -69.75 -33.33 72.3 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.061 -178.457 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 67.6 tp -56.83 -48.52 77.84 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.029 173.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.409 HD13 ' O ' ' A' ' 15' ' ' PHE . 4.9 mp -76.0 -26.47 56.73 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.011 -179.619 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.0 t -72.92 -35.21 66.99 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.479 -178.613 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 -86.87 125.01 33.71 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.379 -0.601 . . . . 0.0 109.379 -178.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.442 ' O ' ' HB2' ' A' ' 26' ' ' GLU . 17.5 ttp180 -46.27 -47.27 18.2 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 122.87 0.468 . . . . 0.0 111.361 -178.283 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -58.59 -41.45 85.82 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.903 -0.59 . . . . 0.0 111.125 -179.172 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -67.09 -52.19 34.01 Favored Glycine 0 N--CA 1.449 -0.444 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.95 -177.434 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.1 tt -56.49 -40.94 75.81 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.091 0.472 . . . . 0.0 110.173 176.147 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.442 ' HB2' ' O ' ' A' ' 22' ' ' ARG . 1.1 tm-20 -59.04 -55.69 31.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.667 179.804 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.534 ' HA ' ' HD3' ' A' ' 30' ' ' ARG . . . -65.85 -39.29 90.61 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.887 -0.597 . . . . 0.0 111.8 -177.196 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -67.33 -40.94 85.96 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.919 -175.445 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 29.1 p -62.81 -45.01 94.61 Favored 'General case' 0 CA--C 1.529 0.147 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 178.238 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.534 ' HD3' ' HA ' ' A' ' 27' ' ' ALA . 53.0 mtp180 -54.23 -44.36 71.64 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.508 176.286 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.57 ' O ' HG22 ' A' ' 34' ' ' THR . 77.6 t80 -58.94 -48.2 82.34 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.756 178.542 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.412 HD23 HG22 ' A' ' 41' ' ' ILE . 14.2 tp -76.05 -10.9 59.79 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.012 -175.056 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -92.56 -9.87 39.64 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.552 177.847 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.57 HG22 ' O ' ' A' ' 31' ' ' PHE . 2.4 t -76.09 -15.57 60.07 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 121.517 0.675 . . . . 0.0 110.019 178.327 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.427 ' O ' ' N ' ' A' ' 37' ' ' SER . 7.9 pt-20 -145.9 90.58 1.99 Allowed 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 108.358 -0.978 . . . . 0.0 108.358 176.013 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 18.2 p90 -29.65 82.63 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 114.279 1.215 . . . . 0.0 114.279 -171.309 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.427 ' N ' ' O ' ' A' ' 35' ' ' GLU . 16.0 m -134.54 9.21 3.66 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 168.938 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -58.78 -32.13 69.02 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 114.1 -1.409 . . . . 0.0 111.603 -175.522 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.497 ' O ' ' HB2' ' A' ' 43' ' ' PHE . 5.1 mp0 -58.76 -20.21 47.52 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.645 -175.34 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.627 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 44.7 m-80 -75.81 -56.64 4.48 Favored 'General case' 0 C--O 1.241 0.646 0 CA-C-O 121.069 0.462 . . . . 0.0 111.092 -179.02 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.474 ' O ' HG13 ' A' ' 45' ' ' ILE . 10.0 tt -62.14 -43.84 98.31 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.217 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 179.511 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.606 ' HA ' ' HB ' ' A' ' 45' ' ' ILE . 52.1 mt-10 -72.75 -16.53 61.64 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.808 -179.009 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.627 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 66.5 t80 -61.27 -58.32 8.76 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 109.833 -0.432 . . . . 0.0 109.833 172.249 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.433 ' O ' ' HB3' ' A' ' 47' ' ' CYS . 37.1 p-90 -78.43 -15.21 58.9 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 119.404 -0.919 . . . . 0.0 111.493 -179.504 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.606 ' HB ' ' HA ' ' A' ' 42' ' ' GLU . 60.4 mt -69.03 -34.3 63.25 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.292 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 168.598 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.67 -31.84 73.13 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.965 -0.562 . . . . 0.0 109.784 173.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.433 ' HB3' ' O ' ' A' ' 44' ' ' TRP . 53.6 t -63.83 -33.6 76.05 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.587 173.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.452 ' HB3' ' O ' ' A' ' 45' ' ' ILE . 15.0 tp10 -66.16 -49.11 68.52 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 109.619 -0.511 . . . . 0.0 109.619 174.671 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.431 ' HA ' ' HG2' ' A' ' 52' ' ' LYS . 0.3 OUTLIER -66.66 -15.79 63.74 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.7 176.188 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.505 ' CZ ' HG23 ' A' ' 59' ' ' ILE . 92.7 t80 -78.44 -43.1 28.11 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.836 -0.62 . . . . 0.0 109.879 174.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.417 ' HD3' ' CE1' ' A' ' 99' ' ' HIS . 31.8 ttpt -61.13 -38.83 87.78 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.182 -179.359 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.431 ' HG2' ' HA ' ' A' ' 49' ' ' ASP . 21.9 ptmt -76.05 14.32 0.72 Allowed 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.665 -177.329 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.459 ' HB2' HD13 ' A' ' 59' ' ' ILE . 6.5 m -94.45 88.62 5.55 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 175.116 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.3 pptp? -74.27 -9.62 58.79 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.297 -177.186 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -91.19 118.52 5.43 Favored Glycine 0 N--CA 1.448 -0.505 0 N-CA-C 111.559 -0.617 . . . . 0.0 111.559 175.562 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.464 ' O ' ' HB ' ' A' ' 59' ' ' ILE . 19.3 Cg_endo -56.65 -30.33 83.24 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 122.847 2.365 . . . . 0.0 112.019 -176.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.412 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 25.1 mt-30 -71.88 -45.32 61.72 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.916 -0.583 . . . . 0.0 109.858 177.805 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 50.9 tp60 -59.0 -33.13 70.36 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 115.531 -0.759 . . . . 0.0 109.848 179.256 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.505 HG23 ' CZ ' ' A' ' 50' ' ' PHE . 23.1 mm -55.24 -56.69 10.12 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.732 174.369 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 18.7 m-70 -59.73 -39.78 85.82 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.211 -176.632 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 57' ' ' GLN . 94.6 mt -58.02 -59.61 5.01 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.387 -177.318 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 58.1 mtmt -72.4 -25.39 61.47 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.401 -176.475 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.61 -49.2 74.24 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 120.954 0.407 . . . . 0.0 110.579 176.711 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -63.83 -37.35 87.05 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.546 -179.207 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -58.9 -52.97 63.46 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.922 179.115 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 68.7 mt -63.53 -35.35 72.24 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.295 179.503 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.519 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 81.3 t80 -54.96 -63.9 1.01 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.7 177.884 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -63.55 -37.53 87.66 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.813 -173.713 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -81.52 -25.09 36.22 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.811 -173.462 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -130.37 -58.8 1.05 Allowed 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 -174.409 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.519 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 51.2 mm -66.81 -29.05 45.06 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.436 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -170.202 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -59.31 144.63 45.89 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.599 -177.506 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 16.9 p -61.63 -58.5 7.84 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.956 0.408 . . . . 0.0 109.928 176.824 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -87.59 85.8 7.13 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 172.083 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -117.03 153.09 49.5 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.932 -175.802 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -74.5 9.58 1.82 Allowed 'Trans proline' 0 C--N 1.349 0.553 0 C-N-CA 122.811 2.341 . . . . 0.0 112.666 178.59 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.622 ' HA ' ' HE3' ' A' ' 77' ' ' LYS . 0.0 OUTLIER -137.61 -52.59 0.65 Allowed 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 122.457 0.303 . . . . 0.0 110.218 177.568 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 64.81 112.7 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.478 0 O-C-N 123.644 0.59 . . . . 0.0 111.301 -179.621 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 39.7 t -104.34 142.07 18.57 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.022 -0.535 . . . . 0.0 109.871 179.445 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 14.9 m120 -78.19 19.93 0.42 Allowed 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.992 0.425 . . . . 0.0 111.0 -180.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 28.4 tp -60.29 145.05 48.97 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.223 178.058 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 5.3 t70 -47.51 128.34 12.35 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.236 176.391 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 83.9 t80 -61.89 -37.1 83.32 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.879 -0.601 . . . . 0.0 110.93 -176.313 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.432 ' O ' HG23 ' A' ' 88' ' ' VAL . 76.7 t60 -66.57 -35.85 81.23 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.664 0.268 . . . . 0.0 110.454 179.112 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 42.4 m -63.7 -44.43 93.7 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.128 0.489 . . . . 0.0 109.826 174.488 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.465 ' O ' HG23 ' A' ' 90' ' ' THR . 57.9 mtpt -62.38 -35.23 78.53 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.98 176.18 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -62.79 -45.08 94.3 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.793 179.738 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.432 HG23 ' O ' ' A' ' 84' ' ' HIS . 74.9 t -58.44 -43.08 85.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.072 0.463 . . . . 0.0 109.981 177.081 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 70.0 mt -68.65 -41.55 82.79 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 CA-C-N 115.647 -0.706 . . . . 0.0 111.248 -177.896 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.465 HG23 ' O ' ' A' ' 86' ' ' LYS . 43.3 p -62.4 -29.74 70.7 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 120.837 0.351 . . . . 0.0 111.114 -178.505 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 -85.66 -35.99 20.57 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.032 178.138 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 32.6 t -87.04 -3.46 59.09 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.438 -0.347 . . . . 0.0 111.485 -176.609 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.1 tp -57.4 -32.3 40.93 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 N-CA-C 111.763 0.283 . . . . 0.0 111.763 -176.436 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 14.6 t -72.98 -31.19 64.37 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 120.739 0.304 . . . . 0.0 110.648 -178.718 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -142.4 79.11 15.9 Favored Pre-proline 0 C--O 1.233 0.19 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 177.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_endo -78.61 157.07 28.35 Favored 'Trans proline' 0 C--O 1.238 0.497 0 C-N-CA 122.614 2.21 . . . . 0.0 112.344 -177.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 41.2 p -85.15 179.69 7.19 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.422 177.224 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.411 ' HG ' ' HG3' ' A' ' 51' ' ' LYS . 41.0 tp -57.3 -34.23 68.49 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.607 -176.21 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . 0.533 ' O ' ' N ' ' A' ' 101' ' ' PHE . 41.9 m-70 -107.44 -28.75 9.64 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-O 119.622 -0.228 . . . . 0.0 111.15 177.09 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 47.1 t 52.06 -76.6 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 123.197 0.599 . . . . 0.0 111.694 178.102 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.533 ' N ' ' O ' ' A' ' 99' ' ' HIS . 34.7 m-85 -70.58 5.46 1.84 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.217 0.607 . . . . 0.0 110.981 179.542 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . 0.503 ' HB2' ' CB ' ' A' ' 99' ' ' HIS . 12.9 t70 -37.49 -54.49 1.13 Allowed 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.343 0.657 . . . . 0.0 112.249 174.595 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -58.45 -39.78 80.79 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 121.194 0.521 . . . . 0.0 110.771 -179.533 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.82 -30.73 69.34 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.635 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.411 ' HB3' ' O ' ' A' ' 102' ' ' ASP . 21.7 tm0? -58.66 -51.27 70.66 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.623 178.181 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 22.2 m -59.72 -44.62 93.64 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.839 -0.618 . . . . 0.0 110.67 179.645 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . 0.45 ' O ' ' HG ' ' A' ' 111' ' ' LEU . 25.5 mmt180 -55.16 -62.58 1.57 Allowed 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.123 179.41 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 66.2 t -63.02 -37.53 79.6 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.119 -175.641 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 30.1 t80 -55.06 -53.3 57.57 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.966 179.223 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.413 ' HG3' ' O ' ' A' ' 107' ' ' ARG . 5.2 pp0? -71.6 -28.99 64.19 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 121.177 -0.209 . . . . 0.0 110.998 -176.896 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' ' 107' ' ' ARG . 84.5 mt -60.17 -47.62 85.15 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 120.974 0.416 . . . . 0.0 110.219 175.632 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . 0.449 ' SD ' ' HB ' ' A' ' 41' ' ' ILE . 36.9 mtm -69.56 -37.82 77.18 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.281 178.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . 0.65 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 40.2 tt0 -58.73 -61.92 2.25 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.695 -177.434 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -53.95 -28.54 37.99 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 -172.28 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -117.91 -61.92 1.62 Allowed 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 -176.19 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 9.2 m -64.7 -34.49 78.42 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.29 -0.414 . . . . 0.0 112.066 -173.583 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . 0.65 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 17.9 t80 -64.68 -54.45 31.41 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 120.442 0.163 . . . . 0.0 111.308 -175.503 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 14.2 t -61.65 -34.67 76.11 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 121.021 0.439 . . . . 0.0 110.435 -179.68 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 32.2 ttt180 -69.12 -37.41 78.33 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.114 -0.494 . . . . 0.0 109.864 179.103 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 82.8 t80 -60.0 -41.02 91.18 Favored 'General case' 0 C--N 1.334 -0.094 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.805 175.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 86.9 mt -61.84 -31.54 71.8 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.561 177.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 15.4 tptm -95.55 -2.65 48.05 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.689 -177.206 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 56.4 p -72.56 159.52 33.76 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 120.741 0.305 . . . . 0.0 110.888 -178.709 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -55.12 -34.4 63.68 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.106 175.061 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 68.6 mt -59.41 -53.68 44.82 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.189 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.231 -178.23 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 70.0 t80 -68.24 -38.96 82.38 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.656 0.265 . . . . 0.0 110.345 -177.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 93.0 mt -61.99 -32.59 73.07 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 120.882 0.372 . . . . 0.0 110.439 177.892 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -68.39 -35.98 78.48 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 115.9 -0.591 . . . . 0.0 109.971 176.055 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.46 HD22 HG11 ' A' ' 3' ' ' VAL . 94.0 mt -78.04 -11.93 59.95 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 115.672 -0.695 . . . . 0.0 111.013 178.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' MET . . . . . . . . . . . . . 4.2 mmt -78.88 -72.31 0.39 Allowed 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.867 178.748 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 40.21 24.79 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 124.02 0.928 . . . . 0.0 112.918 -176.413 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . -59.69 -61.0 7.71 Favored Glycine 0 C--N 1.335 0.478 0 C-N-CA 121.337 -0.458 . . . . 0.0 112.349 -176.753 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . 0.447 ' O ' ' HG3' ' A' ' 133' ' ' ARG . 24.9 ptt85 -138.39 88.75 14.47 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-O 121.209 0.528 . . . . 0.0 110.503 177.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo . . . . . 0 CA--C 1.531 0.35 0 C-N-CA 122.775 2.317 . . . . 0.0 111.415 176.524 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 47.7 t . . . . . 0 N--CA 1.478 0.931 0 CA-C-O 120.565 0.222 . . . . 0.0 110.956 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . 0.429 ' C ' ' SD ' ' A' ' 2' ' ' MET . 0.3 OUTLIER -99.23 123.96 43.92 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 120.888 0.375 . . . . 0.0 110.579 -175.055 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.461 HG21 ' CH2' ' A' ' 11' ' ' TRP . 3.1 p -156.92 141.35 8.07 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.362 179.051 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.0 p -103.36 148.77 36.21 Favored Pre-proline 0 C--N 1.327 -0.383 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 175.096 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_exo -51.78 -24.89 19.36 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 122.836 2.357 . . . . 0.0 112.617 178.355 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.05 -40.92 95.45 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.406 0.622 . . . . 0.0 109.5 176.102 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.41 ' HB3' HG23 ' A' ' 3' ' ' VAL . 9.3 tp10 -74.0 -30.25 62.37 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.803 176.616 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.17 -52.68 61.42 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.727 178.784 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 27.0 m -65.1 -27.01 41.22 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-N 116.503 -0.317 . . . . 0.0 110.487 177.035 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.557 ' O ' ' HD2' ' A' ' 17' ' ' LYS . 5.0 tppt? -61.71 -46.5 89.41 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 175.84 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.461 ' CH2' HG21 ' A' ' 3' ' ' VAL . 47.9 m0 -59.64 -28.81 67.56 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.44 177.507 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -60.3 -17.23 45.72 Favored Glycine 0 C--N 1.334 0.452 0 CA-C-N 115.602 -0.726 . . . . 0.0 112.465 177.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -76.22 -48.51 20.09 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 120.727 0.299 . . . . 0.0 110.952 177.622 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 38.8 m -146.35 121.71 10.29 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-O 121.064 0.459 . . . . 0.0 112.161 -172.23 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.414 ' O ' HD13 ' A' ' 19' ' ' LEU . 22.4 t80 -52.05 -28.38 17.11 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.093 174.303 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -54.27 -58.52 7.09 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.454 175.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.557 ' HD2' ' O ' ' A' ' 10' ' ' LYS . 0.4 OUTLIER -72.15 -16.77 61.98 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.849 -174.058 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 63.0 tp -65.85 -42.91 89.86 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 121.107 0.479 . . . . 0.0 109.764 171.316 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.414 HD13 ' O ' ' A' ' 15' ' ' PHE . 2.7 mp -78.63 -42.43 28.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.529 -176.713 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.553 ' OG ' ' HA ' ' A' ' 17' ' ' LYS . 12.7 p -65.91 -22.94 66.54 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 120.88 0.371 . . . . 0.0 111.091 -178.379 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -82.66 108.92 16.4 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 174.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.5 ptm180 -40.81 -37.33 0.75 Allowed 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.011 0.524 . . . . 0.0 111.806 177.434 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -77.34 -35.31 54.84 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.133 -178.678 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -68.59 -51.88 28.56 Favored Glycine 0 C--N 1.331 0.259 0 N-CA-C 111.417 -0.673 . . . . 0.0 111.417 179.519 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.7 tt -55.55 -37.4 67.93 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.846 -0.428 . . . . 0.0 109.846 174.233 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.564 ' O ' ' HG3' ' A' ' 30' ' ' ARG . 43.0 tt0 -62.34 -47.82 82.55 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.674 178.709 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -66.57 -40.52 89.01 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.108 0.48 . . . . 0.0 110.327 179.123 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -65.34 -41.53 93.83 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.958 -177.013 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.476 HG22 ' O ' ' A' ' 26' ' ' GLU . 10.4 t -66.36 -36.11 82.05 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 120.559 0.219 . . . . 0.0 110.693 -179.0 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.564 ' HG3' ' O ' ' A' ' 26' ' ' GLU . 49.3 mtt180 -59.27 -43.57 92.48 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 121.17 0.51 . . . . 0.0 110.067 177.166 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.582 ' O ' HG22 ' A' ' 34' ' ' THR . 87.9 t80 -72.81 -46.67 51.91 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.778 -179.819 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 20.8 tp -60.28 -26.37 66.43 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.575 -173.278 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.411 ' NZ ' ' OG1' ' A' ' 29' ' ' THR . 46.5 mttp -66.12 -18.57 65.43 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 112.276 0.473 . . . . 0.0 112.276 -179.522 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.582 HG22 ' O ' ' A' ' 31' ' ' PHE . 5.9 t -77.09 -21.06 54.91 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 120.68 0.276 . . . . 0.0 110.84 -179.171 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -111.66 -7.07 14.28 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.965 -178.654 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 96.7 m-85 62.02 17.29 8.91 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.87 -0.605 . . . . 0.0 112.036 175.681 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 32.0 t -78.47 6.54 8.31 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.479 0.656 . . . . 0.0 110.128 178.246 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -64.2 -19.16 65.15 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.605 -176.378 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -58.61 -29.08 66.2 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 121.104 0.478 . . . . 0.0 110.178 177.681 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.602 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 90.5 m-20 -73.82 -50.39 20.66 Favored 'General case' 0 C--O 1.242 0.678 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.029 -179.215 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.473 HG13 ' CZ2' ' A' ' 44' ' ' TRP . 13.3 tt -63.96 -42.36 95.49 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 -179.816 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.54 ' HA ' ' HB ' ' A' ' 45' ' ' ILE . 48.8 mt-10 -65.92 -26.48 67.62 Favored 'General case' 0 N--CA 1.461 0.124 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.77 177.962 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.602 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 37.9 t80 -56.6 -61.35 2.48 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 116.583 -0.28 . . . . 0.0 110.291 175.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.473 ' CZ2' HG13 ' A' ' 41' ' ' ILE . 39.9 p-90 -78.68 -18.29 54.61 Favored 'General case' 0 N--CA 1.463 0.187 0 C-N-CA 119.432 -0.907 . . . . 0.0 111.555 -178.072 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.54 ' HB ' ' HA ' ' A' ' 42' ' ' GLU . 24.0 mt -64.13 -37.37 79.7 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.287 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 169.771 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.04 -35.61 81.28 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 116.096 -0.502 . . . . 0.0 109.7 174.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.83 ' SG ' ' HB2' ' A' ' 101' ' ' PHE . 41.6 t -64.89 -36.09 83.23 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.819 175.131 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.598 ' HA ' ' HB3' ' A' ' 51' ' ' LYS . 15.7 mt-10 -77.95 -25.02 47.98 Favored 'General case' 0 C--N 1.332 -0.168 0 C-N-CA 121.009 -0.276 . . . . 0.0 110.56 177.851 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -64.34 -38.56 91.48 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.851 0.834 . . . . 0.0 108.816 171.005 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -64.73 -37.74 88.62 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 114.405 -1.271 . . . . 0.0 110.102 172.462 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.598 ' HB3' ' HA ' ' A' ' 48' ' ' GLU . 4.7 tmtm? -70.59 -23.1 62.51 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 115.639 -0.709 . . . . 0.0 111.473 178.65 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.481 ' HG3' ' O ' ' A' ' 48' ' ' GLU . 57.6 mtpt -57.83 -37.11 73.25 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 121.164 0.507 . . . . 0.0 110.779 177.25 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.414 ' CB ' ' HG2' ' A' ' 58' ' ' GLN . 10.2 p -91.11 154.26 19.49 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.076 -177.055 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.01 9.66 4.9 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.977 -179.13 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . 0.436 ' O ' HG12 ' A' ' 59' ' ' ILE . . . -83.28 121.23 5.41 Favored Glycine 0 C--N 1.332 0.356 0 N-CA-C 111.465 -0.654 . . . . 0.0 111.465 176.167 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_endo -55.34 -31.7 78.19 Favored 'Trans proline' 0 C--N 1.349 0.6 0 C-N-CA 122.871 2.381 . . . . 0.0 112.768 -174.284 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.51 ' O ' ' HG ' ' A' ' 61' ' ' LEU . 24.6 mp0 -67.12 -51.33 55.36 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 176.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.414 ' HG2' ' CB ' ' A' ' 53' ' ' SER . 7.9 tp60 -55.27 -38.92 69.2 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.414 179.008 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.436 HG12 ' O ' ' A' ' 55' ' ' GLY . 39.9 mm -52.3 -57.82 3.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.056 179.757 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.4 ' CE1' ' HD2' ' A' ' 96' ' ' PRO . 70.5 m-70 -64.37 -37.52 87.8 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.556 -0.293 . . . . 0.0 111.094 -176.798 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 57' ' ' GLN . 89.0 mt -58.26 -60.9 3.04 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-O 120.865 0.364 . . . . 0.0 110.962 -179.141 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 13.8 mptt -65.37 -45.24 84.88 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.234 -177.395 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.8 -49.26 77.21 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.82 0.343 . . . . 0.0 111.333 -178.104 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 64.6 tttm -66.26 -30.77 71.28 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.488 -177.391 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -69.73 -53.98 15.88 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.527 178.375 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 74.3 mt -58.21 -35.49 53.42 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 CA-C-O 121.324 0.583 . . . . 0.0 110.078 177.799 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 85.5 t80 -56.04 -58.27 8.6 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.622 177.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -71.63 -25.42 62.15 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.092 -0.504 . . . . 0.0 112.218 -175.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 65.7 tttp -86.78 -29.02 22.63 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 111.566 0.21 . . . . 0.0 111.566 -176.705 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -127.76 -53.94 1.33 Allowed 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -174.754 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 45.2 mm -71.51 -19.77 20.69 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.487 0 CA-C-O 120.77 0.319 . . . . 0.0 111.575 -171.238 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.501 ' HB3' ' HB2' ' A' ' 75' ' ' ALA . 53.9 tp60 -51.74 135.89 28.5 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.811 178.544 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 19.3 p -50.8 -49.79 57.65 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.942 -176.119 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -85.89 -62.89 1.42 Allowed 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 174.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.501 ' HB2' ' HB3' ' A' ' 72' ' ' GLN . . . 60.09 158.57 0.11 Allowed Pre-proline 0 N--CA 1.469 0.485 0 C-N-CA 122.996 0.518 . . . . 0.0 112.253 176.316 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -70.18 -23.76 28.53 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.218 1.945 . . . . 0.0 111.26 173.097 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt -95.81 -41.11 9.0 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.079 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 55.81 88.52 0.04 OUTLIER 'General case' 0 C--O 1.234 0.266 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 -172.142 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.477 HG12 ' H ' ' A' ' 81' ' ' LEU . 24.3 t -90.91 126.34 43.64 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.683 -172.499 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 37.1 m-80 -74.73 15.89 0.33 Allowed 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.591 -177.442 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.477 ' H ' HG12 ' A' ' 79' ' ' VAL . 16.8 tp -57.17 146.97 26.23 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.212 -0.449 . . . . 0.0 109.883 174.734 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -46.89 131.07 12.12 Favored 'General case' 0 C--O 1.237 0.414 0 O-C-N 123.606 0.566 . . . . 0.0 112.39 -176.524 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 36.6 p90 -55.94 -44.98 78.89 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.155 -0.93 . . . . 0.0 111.744 -177.39 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.455 ' O ' HG23 ' A' ' 88' ' ' VAL . 81.1 t60 -67.92 -32.83 73.56 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.83 0.348 . . . . 0.0 110.32 -176.661 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 49.7 m -65.86 -47.19 75.75 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.025 176.696 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.421 ' HE2' ' O ' ' A' ' 81' ' ' LEU . 58.0 mtmt -65.06 -30.72 71.7 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.151 176.959 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -63.52 -50.0 71.31 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.827 179.035 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.455 HG23 ' O ' ' A' ' 84' ' ' HIS . 91.8 t -56.77 -44.91 82.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 121.003 0.43 . . . . 0.0 110.173 178.489 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 70.5 mt -63.22 -47.43 92.3 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.073 -178.768 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 20.2 p -61.64 -26.07 67.77 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 120.763 0.316 . . . . 0.0 111.681 -176.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 42.0 m-80 -94.85 -14.69 24.35 Favored 'General case' 0 N--CA 1.465 0.301 0 N-CA-C 111.663 0.245 . . . . 0.0 111.663 178.907 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 33.0 m -108.45 -4.77 17.03 Favored 'General case' 0 N--CA 1.468 0.425 0 N-CA-C 111.664 0.246 . . . . 0.0 111.664 -177.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.448 ' O ' ' HD3' ' A' ' 96' ' ' PRO . 9.6 tp -61.35 -18.72 18.99 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.456 0 CA-C-O 120.878 0.371 . . . . 0.0 111.363 -177.757 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.524 HG23 ' HG2' ' A' ' 95' ' ' GLN . 8.9 t -60.72 -29.55 69.43 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.595 177.667 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.524 ' HG2' HG23 ' A' ' 94' ' ' THR . 3.4 pt20 -149.2 77.44 9.05 Favored Pre-proline 0 CA--C 1.532 0.288 0 CA-C-O 121.351 0.596 . . . . 0.0 110.172 178.123 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.448 ' HD3' ' O ' ' A' ' 93' ' ' ILE . 72.3 Cg_endo -73.78 129.76 13.86 Favored 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.602 2.201 . . . . 0.0 112.125 -178.033 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 68.7 p -85.04 175.3 9.11 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.29 177.615 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 31.1 tp -60.56 -19.12 56.5 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 121.434 0.635 . . . . 0.0 110.675 -179.118 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . 0.79 ' HB3' ' HB2' ' A' ' 102' ' ' ASP . 28.5 m-70 -128.49 39.16 3.86 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.76 -0.655 . . . . 0.0 109.987 178.226 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 22.4 t -59.41 -30.99 68.86 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.121 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.83 ' HB2' ' SG ' ' A' ' 47' ' ' CYS . 59.0 m-85 -104.38 19.74 19.72 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.578 -178.704 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . 0.79 ' HB2' ' HB3' ' A' ' 99' ' ' HIS . 24.2 t70 -58.88 -43.07 90.84 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.265 -175.786 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.463 ' O ' ' HG2' ' A' ' 107' ' ' ARG . . . -68.66 -41.29 79.51 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.105 179.232 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -58.42 -39.9 81.05 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.166 178.035 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.463 ' HG2' ' HB2' ' A' ' 44' ' ' TRP . 23.0 tm0? -57.54 -51.27 70.15 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.337 -0.847 . . . . 0.0 109.769 177.833 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 36.3 t -63.61 -37.08 85.98 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.159 -178.102 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . 0.529 ' O ' ' HG ' ' A' ' 111' ' ' LEU . 12.3 mmm180 -67.25 -46.88 72.41 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-O 120.504 0.192 . . . . 0.0 111.095 -178.553 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 61.4 t -68.85 -34.99 67.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-O 121.348 0.594 . . . . 0.0 109.927 177.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 2.6 t80 -55.49 -51.75 65.94 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.548 175.087 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.478 ' O ' ' HG2' ' A' ' 114' ' ' GLN . 3.9 pt20 -69.68 -29.67 67.16 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.608 -0.269 . . . . 0.0 111.068 -177.819 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 107' ' ' ARG . 80.9 mt -63.02 -43.55 98.42 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 120.907 0.384 . . . . 0.0 110.465 177.295 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 43.5 mtm -74.27 -28.52 61.25 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.024 0.44 . . . . 0.0 110.06 177.605 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . 0.609 ' HA ' ' HB3' ' A' ' 117' ' ' TYR . 8.2 tm-20 -60.28 -65.48 0.68 Allowed 'General case' 0 C--O 1.236 0.373 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.333 179.211 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . 0.478 ' HG2' ' O ' ' A' ' 110' ' ' GLN . 14.6 pt20 -56.22 -28.7 59.33 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 113.027 0.751 . . . . 0.0 113.027 -174.468 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -105.91 -62.38 1.38 Allowed 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 112.285 0.476 . . . . 0.0 112.285 -176.473 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 12.9 m -75.93 -37.95 58.17 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 111.933 0.345 . . . . 0.0 111.933 -173.346 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . 0.609 ' HB3' ' HA ' ' A' ' 113' ' ' GLU . 25.6 t80 -72.83 -40.43 65.77 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.775 -0.193 . . . . 0.0 111.136 -174.328 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 24.6 p -57.57 -53.22 60.68 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-O 121.368 0.604 . . . . 0.0 109.851 175.653 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . 0.436 HH11 ' HD3' ' A' ' 119' ' ' ARG . 28.9 mtp-105 -58.75 -38.47 78.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.007 177.119 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 89.2 t80 -61.6 -39.18 90.31 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.735 179.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.488 HD11 ' CZ ' ' A' ' 117' ' ' TYR . 82.4 mt -70.09 -27.24 64.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.816 0.341 . . . . 0.0 110.88 179.167 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . 0.76 ' HA ' ' HE3' ' A' ' 122' ' ' LYS . 0.2 OUTLIER -100.41 1.49 41.37 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.112 -178.979 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 83.5 p -64.68 148.14 51.62 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 120.778 0.323 . . . . 0.0 110.838 -177.587 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -63.06 -35.28 79.71 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.523 -178.602 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 6.4 tp -64.12 -40.37 88.8 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.864 178.002 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 83.2 t80 -60.34 -43.09 96.77 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.145 0.498 . . . . 0.0 109.893 178.28 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 69.4 mt -66.12 -31.52 72.42 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.436 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -64.84 -38.77 92.09 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 116.204 -0.453 . . . . 0.0 109.997 176.676 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 86.6 mt -61.7 -40.71 95.98 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.927 175.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' MET . . . . . . . . . . . . . 86.9 mmm -64.72 -33.88 77.0 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.412 179.45 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 14.1 tp10 -59.28 -27.06 65.49 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.353 176.152 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . -60.75 -36.27 91.47 Favored Glycine 0 N--CA 1.45 -0.409 0 CA-C-N 115.951 -0.568 . . . . 0.0 112.096 177.841 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 33.1 mtm180 64.7 147.35 0.1 OUTLIER Pre-proline 0 CA--C 1.536 0.431 0 C-N-CA 122.887 0.475 . . . . 0.0 111.22 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_exo . . . . . 0 C--N 1.347 0.492 0 C-N-CA 122.536 2.158 . . . . 0.0 112.286 -179.738 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 20.2 m . . . . . 0 N--CA 1.477 0.914 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 27.6 ttt -89.49 101.98 14.66 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 109.149 -0.685 . . . . 0.0 109.149 173.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 5.5 p -83.84 139.33 17.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 115.826 -0.624 . . . . 0.0 111.239 -177.534 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 20.0 m -86.72 148.25 45.62 Favored Pre-proline 0 CA--C 1.534 0.33 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 175.286 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -53.63 -30.63 56.27 Favored 'Trans proline' 0 C--N 1.35 0.645 0 C-N-CA 122.743 2.295 . . . . 0.0 113.04 -173.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 28.5 tp10 -60.52 -43.15 97.45 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 121.173 0.511 . . . . 0.0 110.303 177.155 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -76.55 -32.5 58.24 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.944 179.478 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.14 -49.91 70.28 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.989 -0.55 . . . . 0.0 110.848 179.19 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 33.7 m -66.9 -28.34 42.69 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 177.539 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.568 ' O ' ' HD2' ' A' ' 17' ' ' LYS . 8.4 tppt? -57.85 -48.85 78.59 Favored 'General case' 0 CA--C 1.527 0.094 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.388 176.523 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.437 ' HB3' HD13 ' A' ' 18' ' ' LEU . 49.1 m0 -59.54 -33.11 70.97 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.505 178.224 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -69.11 -8.18 58.07 Favored Glycine 0 C--N 1.331 0.281 0 CA-C-N 115.767 -0.651 . . . . 0.0 112.903 -178.607 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -79.37 -34.14 42.29 Favored 'General case' 0 C--N 1.33 -0.248 0 O-C-N 122.839 -0.212 . . . . 0.0 110.618 177.647 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.477 ' HB3' ' HG2' ' A' ' 17' ' ' LYS . 35.5 t -161.0 129.26 4.43 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 120.996 0.427 . . . . 0.0 111.56 -176.01 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.45 ' O ' HD13 ' A' ' 19' ' ' LEU . 10.1 t80 -58.23 -27.61 64.1 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.597 175.775 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -60.78 -48.71 80.56 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.048 177.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.568 ' HD2' ' O ' ' A' ' 10' ' ' LYS . 19.3 ptpt -80.19 -11.74 59.71 Favored 'General case' 0 C--O 1.233 0.192 0 C-N-CA 120.8 -0.36 . . . . 0.0 110.796 -177.007 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.437 HD13 ' HB3' ' A' ' 11' ' ' TRP . 60.0 tp -69.0 -45.93 69.32 Favored 'General case' 0 CA--C 1.53 0.196 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 170.411 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.45 HD13 ' O ' ' A' ' 15' ' ' PHE . 8.0 mp -61.83 -30.31 70.75 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.839 176.268 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 22.4 t -58.12 -21.13 45.19 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.168 178.439 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . 0.474 ' HB3' ' H ' ' A' ' 24' ' ' GLY . 0.8 OUTLIER -102.41 136.5 42.12 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 176.634 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.03 -47.56 50.89 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 121.137 0.494 . . . . 0.0 110.098 177.329 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 30.2 p-10 -69.78 -33.9 73.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.277 178.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.474 ' H ' ' HB3' ' A' ' 21' ' ' HIS . . . -64.14 -45.5 93.57 Favored Glycine 0 C--N 1.333 0.377 0 N-CA-C 111.388 -0.685 . . . . 0.0 111.388 173.363 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.5 tp -53.38 -52.4 59.41 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.365 0.603 . . . . 0.0 110.158 174.067 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.644 ' O ' ' HG2' ' A' ' 30' ' ' ARG . 27.9 tt0 -60.33 -42.4 95.56 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.514 -177.663 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.4 ' O ' ' HB2' ' A' ' 30' ' ' ARG . . . -55.21 -47.3 75.51 Favored 'General case' 0 C--O 1.24 0.574 0 CA-C-O 121.28 0.562 . . . . 0.0 110.134 177.669 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 90.6 t80 -59.92 -49.09 79.04 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.633 178.236 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.563 HG22 ' HA ' ' A' ' 26' ' ' GLU . 6.0 t -65.88 -24.57 66.88 Favored 'General case' 0 C--O 1.225 -0.211 0 C-N-CA 120.567 -0.453 . . . . 0.0 110.571 -177.243 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.644 ' HG2' ' O ' ' A' ' 26' ' ' GLU . 31.5 mmt180 -57.56 -48.96 77.91 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 173.391 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.601 ' O ' HG22 ' A' ' 34' ' ' THR . 86.5 t80 -69.73 -33.83 73.02 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.655 178.434 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.46 HD23 ' HB ' ' A' ' 41' ' ' ILE . 27.5 tp -72.71 -26.19 61.5 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-O 121.005 0.431 . . . . 0.0 110.916 -178.241 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.491 ' HG3' ' O ' ' A' ' 29' ' ' THR . 28.2 mtpp -75.4 -38.29 59.97 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.336 -0.393 . . . . 0.0 111.091 179.652 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.601 HG22 ' O ' ' A' ' 31' ' ' PHE . 12.0 t -68.18 -15.96 63.79 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 120.804 0.335 . . . . 0.0 110.825 -176.689 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -109.55 23.78 13.97 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.265 175.437 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 50.4 p90 45.12 26.24 0.22 Allowed 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.603 1.161 . . . . 0.0 113.587 174.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 10.4 t -108.04 20.13 19.11 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.043 0.449 . . . . 0.0 110.193 -179.219 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.631 ' O ' HG22 ' A' ' 41' ' ' ILE . 10.2 pt-20 -63.34 -22.44 66.88 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.564 -176.603 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -53.02 -26.37 15.3 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.662 0.268 . . . . 0.0 111.263 -179.584 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.433 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 8.4 m120 -67.12 -49.7 63.99 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-O 121.047 0.451 . . . . 0.0 110.447 177.761 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.631 HG22 ' O ' ' A' ' 38' ' ' GLU . 6.3 tp -63.85 -42.75 96.87 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.122 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.197 -176.555 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -71.63 -25.84 62.32 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.26 -178.193 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.445 ' HE1' ' HB3' ' A' ' 70' ' ' PHE . 41.3 t80 -60.57 -67.86 0.36 Allowed 'General case' 0 C--O 1.237 0.412 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.969 179.483 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.512 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 35.6 p-90 -75.96 -23.57 55.36 Favored 'General case' 0 C--O 1.225 -0.187 0 C-N-CA 119.402 -0.919 . . . . 0.0 111.954 -174.821 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 26.4 mt -57.9 -38.67 67.58 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 C-N-CA 120.405 -0.518 . . . . 0.0 109.769 172.237 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.407 ' O ' ' HB2' ' A' ' 49' ' ' ASP . . . -66.03 -37.24 85.39 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 121.137 0.494 . . . . 0.0 110.034 175.19 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.575 ' O ' ' HB3' ' A' ' 50' ' ' PHE . 71.6 m -72.15 -17.17 61.98 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 115.933 -0.576 . . . . 0.0 111.297 177.685 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.512 ' HG2' ' O ' ' A' ' 44' ' ' TRP . 12.3 mm-40 -73.98 -37.36 64.48 Favored 'General case' 0 C--O 1.225 -0.22 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 171.286 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.461 ' O ' ' HB2' ' A' ' 52' ' ' LYS . 5.8 m-20 -59.12 -29.77 67.64 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 172.149 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.575 ' HB3' ' O ' ' A' ' 47' ' ' CYS . 85.2 t80 -64.43 -40.61 96.08 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.971 173.875 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.566 ' HE3' ' CE1' ' A' ' 99' ' ' HIS . 60.0 mttp -58.87 -31.78 68.87 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 121.091 0.472 . . . . 0.0 110.236 173.552 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.56 ' N ' ' HE2' ' A' ' 52' ' ' LYS . 1.1 mpmm? -70.1 -24.73 63.25 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.419 -179.851 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.475 ' HB3' ' HG3' ' A' ' 58' ' ' GLN . 39.1 m -60.73 127.42 31.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.714 0.768 . . . . 0.0 110.963 -177.289 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 28.5 tptp -110.58 128.7 55.77 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 114.647 -1.161 . . . . 0.0 110.152 -176.072 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 100.68 131.64 7.46 Favored Glycine 0 CA--C 1.519 0.282 0 N-CA-C 111.701 -0.56 . . . . 0.0 111.701 -178.292 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.476 ' O ' ' HD2' ' A' ' 60' ' ' HIS . 12.1 Cg_endo -54.54 -46.52 32.84 Favored 'Trans proline' 0 C--N 1.349 0.599 0 C-N-CA 122.794 2.329 . . . . 0.0 111.847 -178.492 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -53.7 -48.0 69.96 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.058 0.456 . . . . 0.0 110.282 178.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.475 ' HG3' ' HB3' ' A' ' 53' ' ' SER . 8.4 tp-100 -55.57 -42.77 75.18 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.121 177.033 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.537 HG22 ' HG2' ' A' ' 96' ' ' PRO . 47.5 mm -60.85 -39.9 83.44 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.325 0 CA-C-N 115.833 -0.621 . . . . 0.0 111.024 179.334 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.476 ' HD2' ' O ' ' A' ' 56' ' ' PRO . 74.2 m-70 -61.93 -55.02 33.84 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-O 120.673 0.273 . . . . 0.0 110.854 -179.207 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.539 HD12 ' N ' ' A' ' 62' ' ' LYS . 4.2 pp -67.69 -35.66 79.23 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.357 -176.217 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.539 ' N ' HD12 ' A' ' 61' ' ' LEU . 32.0 mmtp -65.67 -38.8 90.31 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 120.946 0.403 . . . . 0.0 110.005 176.363 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.83 -49.03 79.13 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.751 179.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 53.7 mmtt -54.26 -43.07 70.64 Favored 'General case' 0 N--CA 1.466 0.351 0 O-C-N 123.273 0.358 . . . . 0.0 111.191 178.256 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.02 -61.07 2.55 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.064 -179.895 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 63.9 mt -64.08 -37.6 80.27 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.308 0 CA-C-O 121.334 0.588 . . . . 0.0 110.586 -178.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -57.24 -57.39 12.84 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.179 -177.135 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -78.15 -23.04 47.9 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.919 -172.796 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -99.76 -16.82 17.98 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -174.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.445 ' HB3' ' HE1' ' A' ' 43' ' ' PHE . 97.3 m-85 -132.56 -49.17 0.9 Allowed 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 -176.405 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 50.6 mm -74.89 -32.51 27.88 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -169.725 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 51.2 mm-40 -64.67 143.44 57.92 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.98 0.419 . . . . 0.0 111.556 179.818 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 22.1 m -62.46 -28.94 70.17 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.847 -0.615 . . . . 0.0 110.212 177.223 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -98.47 24.43 7.38 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.501 -178.211 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -89.57 152.31 47.03 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.58 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_exo -67.34 15.81 0.13 Allowed 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 123.248 2.632 . . . . 0.0 113.732 -177.165 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -130.4 -27.21 2.21 Favored 'General case' 0 C--N 1.331 -0.238 0 O-C-N 122.333 -0.229 . . . . 0.0 111.236 177.852 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 48.73 42.21 19.27 Favored 'General case' 0 N--CA 1.466 0.353 0 O-C-N 123.498 0.499 . . . . 0.0 110.937 177.055 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 58.3 t -47.47 133.34 4.42 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 CA-C-N 115.264 -0.88 . . . . 0.0 111.848 -174.653 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.475 HD22 ' N ' ' A' ' 80' ' ' ASN . 0.9 OUTLIER -70.84 76.46 0.62 Allowed 'General case' 0 C--O 1.237 0.413 0 CA-C-O 121.283 0.563 . . . . 0.0 110.911 -178.558 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.569 HD23 ' HB3' ' A' ' 86' ' ' LYS . 55.2 tp -113.79 144.68 42.59 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.32 -0.854 . . . . 0.0 109.918 177.075 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -67.2 145.73 54.92 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-O 120.815 0.341 . . . . 0.0 110.91 178.644 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 91.7 t80 -58.32 -50.85 72.16 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.465 -176.602 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.438 ' O ' ' HB3' ' A' ' 87' ' ' GLU . 85.7 t60 -61.14 -33.26 73.12 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.615 0.245 . . . . 0.0 111.176 -175.61 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 25.7 m -69.03 -50.13 51.43 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.805 0.336 . . . . 0.0 110.79 178.671 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.569 ' HB3' HD23 ' A' ' 81' ' ' LEU . 12.2 ptmm? -70.69 -19.96 62.73 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 121.084 0.468 . . . . 0.0 110.295 178.645 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.438 ' HB3' ' O ' ' A' ' 84' ' ' HIS . 37.1 tt0 -61.84 -54.77 37.66 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.824 -0.625 . . . . 0.0 109.613 173.6 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 84' ' ' HIS . 59.2 t -55.01 -41.24 57.65 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.215 178.077 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 73.2 mt -60.15 -53.21 51.74 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.118 179.722 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.522 HG23 ' O ' ' A' ' 86' ' ' LYS . 66.7 p -58.48 -30.57 67.1 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 120.799 0.333 . . . . 0.0 111.596 -176.173 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 41.8 m-80 -83.53 -29.56 27.79 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.492 -179.521 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 16.1 m -101.14 -0.99 35.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.711 0.291 . . . . 0.0 111.4 -175.55 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.5 tp -61.97 -21.2 25.61 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-O 120.851 0.358 . . . . 0.0 111.357 -176.65 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 9.5 t -62.64 -37.83 87.89 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.623 179.255 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -138.83 77.15 33.14 Favored Pre-proline 0 C--O 1.234 0.272 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.259 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.537 ' HG2' HG22 ' A' ' 59' ' ' ILE . 72.8 Cg_endo -76.92 151.76 31.43 Favored 'Trans proline' 0 C--O 1.235 0.374 0 C-N-CA 122.649 2.232 . . . . 0.0 112.102 -178.173 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . 0.455 HG22 ' H ' ' A' ' 98' ' ' LEU . 5.8 m -96.43 168.71 10.39 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 116.035 -0.529 . . . . 0.0 109.823 178.353 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.455 ' H ' HG22 ' A' ' 97' ' ' THR . 61.1 tp -45.79 -36.61 5.29 Favored 'General case' 0 N--CA 1.469 0.507 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 -175.275 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . 0.791 ' HB3' ' HB2' ' A' ' 102' ' ' ASP . 55.1 m-70 -98.13 -52.5 3.67 Favored 'General case' 0 N--CA 1.464 0.242 0 O-C-N 122.25 -0.281 . . . . 0.0 110.852 -179.255 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 33.2 t 51.5 -81.94 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.105 0.562 . . . . 0.0 112.507 174.923 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . 0.444 ' N ' ' O ' ' A' ' 99' ' ' HIS . 50.4 m-85 -74.55 -1.55 21.91 Favored 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 122.635 0.374 . . . . 0.0 111.287 -174.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . 0.791 ' HB2' ' HB3' ' A' ' 99' ' ' HIS . 8.0 t70 -51.52 -43.53 62.3 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.44 -176.205 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -59.33 -41.29 88.8 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 121.256 0.551 . . . . 0.0 110.373 177.269 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -64.09 -36.35 83.73 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.348 178.181 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.443 ' OE1' ' SG ' ' A' ' 47' ' ' CYS . 15.9 mm-40 -66.38 -36.84 83.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.583 -0.735 . . . . 0.0 109.449 179.583 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 52.0 m -62.06 -35.4 78.51 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.573 177.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . 0.514 ' O ' ' HG3' ' A' ' 110' ' ' GLN . 0.0 OUTLIER -60.69 -49.47 77.4 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-O 121.025 0.441 . . . . 0.0 110.06 178.228 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.485 HG12 ' SD ' ' A' ' 112' ' ' MET . 96.7 t -64.28 -46.0 94.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.285 178.022 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -52.5 -47.06 66.82 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.601 179.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . 0.514 ' HG3' ' O ' ' A' ' 107' ' ' ARG . 0.0 OUTLIER -70.64 -31.06 67.85 Favored 'General case' 0 N--CA 1.465 0.301 0 C-N-CA 121.139 -0.224 . . . . 0.0 110.773 -176.077 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.534 ' HA ' HE21 ' A' ' 114' ' ' GLN . 95.2 mt -62.58 -49.0 77.0 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.482 0.658 . . . . 0.0 109.339 172.831 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . 0.485 ' SD ' HG12 ' A' ' 108' ' ' VAL . 66.0 mtp -60.42 -38.17 83.21 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.296 178.811 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . 0.613 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 39.7 tt0 -61.23 -65.72 0.65 Allowed 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.718 -178.825 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . 0.534 HE21 ' HA ' ' A' ' 111' ' ' LEU . 27.2 pt20 -60.93 -32.34 71.84 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.861 -174.426 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -90.4 -70.29 0.68 Allowed 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.11 0.411 . . . . 0.0 112.11 -177.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 4.7 p -86.28 -25.01 25.72 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 -169.115 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . 0.613 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 38.2 t80 -71.55 -41.08 69.55 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 118.398 0.545 . . . . 0.0 110.659 -178.407 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 31.6 p -60.35 -51.99 67.17 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 121.321 0.581 . . . . 0.0 110.141 176.799 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 43.2 mtm-85 -59.03 -36.04 74.31 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.445 177.434 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 65.7 t80 -62.78 -38.09 89.25 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.616 177.442 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 82.5 mt -65.35 -27.22 68.43 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.788 0.327 . . . . 0.0 110.641 178.583 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . 0.783 ' HA ' ' HE2' ' A' ' 122' ' ' LYS . 10.4 mmpt? -102.6 1.83 35.28 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.784 178.729 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . 0.457 ' OG ' HG22 ' A' ' 125' ' ' ILE . 79.0 p -72.96 143.16 47.74 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.749 0.309 . . . . 0.0 110.707 -179.352 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -59.99 -25.98 65.69 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.213 178.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.474 HD13 ' O ' ' A' ' 125' ' ' ILE . 0.0 OUTLIER -67.27 -36.64 77.27 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 177.854 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 84.0 t80 -64.61 -38.45 91.06 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 121.068 0.461 . . . . 0.0 109.913 174.696 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.528 HD13 ' HG3' ' A' ' 130' ' ' MET . 4.4 mm? -65.17 -22.59 66.93 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.751 177.027 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . 0.41 ' HB3' ' O ' ' A' ' 125' ' ' ILE . 24.8 t70 -73.9 -33.44 64.0 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 121.193 0.521 . . . . 0.0 109.683 173.96 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 66.9 mt -72.76 -23.38 60.81 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.796 178.09 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' MET . . . . . 0.528 ' HG3' HD13 ' A' ' 127' ' ' LEU . 2.4 mmt -60.72 -69.54 0.22 Allowed 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 115.967 -0.56 . . . . 0.0 110.954 179.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 52.39 34.47 15.17 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 121.867 0.841 . . . . 0.0 109.844 -177.712 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . -84.15 61.06 4.77 Favored Glycine 0 N--CA 1.45 -0.39 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.96 -178.513 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 24.1 ttm180 -76.69 117.14 62.63 Favored Pre-proline 0 C--N 1.327 -0.389 0 C-N-CA 122.259 0.224 . . . . 0.0 110.438 179.221 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo . . . . . 0 C--N 1.347 0.48 0 C-N-CA 122.644 2.229 . . . . 0.0 112.757 -179.742 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 48.2 t . . . . . 0 N--CA 1.481 1.097 0 CA-C-O 120.68 0.276 . . . . 0.0 110.313 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 26.9 ptt? -64.43 127.01 29.66 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.032 177.65 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.2 p -93.44 143.61 11.17 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 CA-C-O 120.776 0.322 . . . . 0.0 110.885 -178.403 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 49.8 m -80.02 141.87 55.11 Favored Pre-proline 0 C--O 1.236 0.349 0 CA-C-N 116.148 -0.478 . . . . 0.0 109.996 176.136 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 78.1 Cg_exo -51.39 -35.01 52.91 Favored 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 122.804 2.336 . . . . 0.0 112.898 -177.14 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.526 ' O ' ' HG2' ' A' ' 10' ' ' LYS . 14.5 mm-40 -69.0 -34.68 75.67 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.991 -179.359 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 23.4 mm-40 -71.44 -32.79 68.75 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 172.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.35 -42.81 98.95 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.706 178.944 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.483 HG22 ' O ' ' A' ' 6' ' ' GLU . 17.4 m -69.71 -28.31 36.79 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-O 120.98 0.419 . . . . 0.0 110.087 176.914 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.541 ' HA ' ' HG2' ' A' ' 13' ' ' GLU . 71.6 mmtt -66.56 -31.06 71.53 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.368 174.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.437 ' CD1' ' HG2' ' A' ' 17' ' ' LYS . 48.2 m0 -62.24 -25.75 68.0 Favored 'General case' 0 N--CA 1.463 0.189 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 173.183 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -79.85 -22.99 62.76 Favored Glycine 0 C--N 1.333 0.405 0 CA-C-N 115.565 -0.743 . . . . 0.0 112.927 -178.551 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.541 ' HG2' ' HA ' ' A' ' 10' ' ' LYS . 8.2 pt-20 -101.88 -18.07 15.89 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.821 0.31 . . . . 0.0 110.871 178.278 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 42.1 m -134.8 96.97 3.65 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.893 0.377 . . . . 0.0 111.519 -177.779 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 12.5 t80 -58.28 -34.13 70.18 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 175.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -54.55 -48.94 71.41 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.802 174.367 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.451 ' HD2' ' HB3' ' A' ' 10' ' ' LYS . 22.0 ttmm -67.22 -35.24 79.17 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.8 -177.494 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 67.1 tp -57.63 -49.58 75.96 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.066 -0.516 . . . . 0.0 109.924 176.453 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 5.5 mp -73.45 -30.26 63.08 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.966 179.748 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 26.0 t -63.73 -41.12 98.11 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.194 179.666 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 21.1 m-70 -77.49 115.88 17.61 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 109.175 -0.676 . . . . 0.0 109.175 175.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.411 ' HD2' ' N ' ' A' ' 22' ' ' ARG . 8.3 mpt_? -53.15 -35.26 59.56 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 120.86 0.362 . . . . 0.0 110.667 -177.852 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -66.25 -42.99 87.76 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.378 177.521 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -65.68 -50.51 53.66 Favored Glycine 0 C--N 1.335 0.483 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.877 179.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 11.5 tp -47.83 -51.59 22.18 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.367 0.603 . . . . 0.0 110.584 174.514 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.505 ' O ' ' HG3' ' A' ' 30' ' ' ARG . 12.8 tp10 -65.03 -40.25 94.56 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.066 -0.97 . . . . 0.0 110.77 -176.7 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.07 -41.76 98.5 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.046 0.451 . . . . 0.0 110.629 178.281 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 83.5 t80 -71.71 -45.57 61.4 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.152 -176.201 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.635 ' O ' ' HG3' ' A' ' 33' ' ' LYS . 9.0 t -60.79 -45.27 95.05 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 120.937 -0.305 . . . . 0.0 110.399 -177.788 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.505 ' HG3' ' O ' ' A' ' 26' ' ' GLU . 73.8 mtt-85 -58.92 -40.48 84.67 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 121.017 0.437 . . . . 0.0 109.988 178.361 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.525 ' O ' HG22 ' A' ' 34' ' ' THR . 94.5 t80 -63.92 -30.88 71.93 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.479 177.549 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.482 HD23 HG22 ' A' ' 41' ' ' ILE . 18.9 tp -85.72 -20.11 29.82 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.464 -179.028 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.635 ' HG3' ' O ' ' A' ' 29' ' ' THR . 66.1 mttm -77.6 -36.14 52.11 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.018 178.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.525 HG22 ' O ' ' A' ' 31' ' ' PHE . 14.8 t -63.81 -29.96 71.1 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 120.884 0.373 . . . . 0.0 110.972 -177.919 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -91.99 2.77 56.34 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.412 177.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 89.9 m-85 55.96 47.22 20.41 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.318 179.176 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 20.3 t -131.17 15.17 5.14 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.673 -0.694 . . . . 0.0 109.466 176.188 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.428 ' HB2' ' OE1' ' A' ' 42' ' ' GLU . 0.1 OUTLIER -57.16 -24.25 53.06 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 115.172 -0.922 . . . . 0.0 111.199 -179.374 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.453 ' O ' ' HB2' ' A' ' 43' ' ' PHE . 11.4 pt-20 -40.13 -36.06 0.46 Allowed 'General case' 0 C--O 1.225 -0.236 0 CA-C-N 115.205 -0.907 . . . . 0.0 112.161 178.442 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.456 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 46.5 m-80 -66.95 -62.17 1.57 Allowed 'General case' 0 C--O 1.245 0.816 0 CA-C-O 121.07 0.462 . . . . 0.0 111.528 -176.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.521 HD13 ' HB ' ' A' ' 29' ' ' THR . 13.1 tt -62.43 -44.09 98.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.194 -176.608 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.428 ' OE1' ' HB2' ' A' ' 38' ' ' GLU . 0.9 OUTLIER -63.17 -31.5 72.66 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.071 177.365 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.456 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 76.3 t80 -55.93 -60.77 2.99 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 120.706 0.288 . . . . 0.0 110.828 179.935 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.51 ' HB2' ' HG3' ' A' ' 105' ' ' GLN . 28.6 p-90 -78.05 -11.16 59.89 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 119.722 -0.791 . . . . 0.0 111.929 -176.15 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.481 HG13 ' O ' ' A' ' 41' ' ' ILE . 54.2 mt -68.66 -39.68 80.68 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 168.2 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.55 -32.37 73.99 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.898 174.157 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.413 ' O ' ' HB3' ' A' ' 50' ' ' PHE . 43.4 t -66.54 -28.78 68.81 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.583 175.792 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.521 ' O ' ' HG3' ' A' ' 51' ' ' LYS . 4.3 tm-20 -72.81 -40.08 66.13 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 177.134 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -65.04 -33.75 76.79 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.821 174.575 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . 0.413 ' HB3' ' O ' ' A' ' 47' ' ' CYS . 74.0 t80 -60.67 -58.73 7.23 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.901 177.017 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.521 ' HG3' ' O ' ' A' ' 48' ' ' GLU . 0.0 OUTLIER -63.29 -20.75 65.76 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 116.615 -0.266 . . . . 0.0 111.491 -179.139 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -72.05 -26.81 62.33 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.893 0.378 . . . . 0.0 110.685 177.216 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 42.7 m -66.65 106.86 1.93 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.996 -177.124 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.24 -4.84 56.95 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.929 179.788 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -80.43 117.04 4.37 Favored Glycine 0 CA--C 1.52 0.373 0 N-CA-C 111.529 -0.628 . . . . 0.0 111.529 175.775 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_exo -50.82 -46.53 29.86 Favored 'Trans proline' 0 C--N 1.351 0.666 0 C-N-CA 122.921 2.414 . . . . 0.0 112.687 -177.191 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 7.3 pm0 -71.57 -33.2 68.89 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.037 0.446 . . . . 0.0 109.946 179.562 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -62.2 -36.62 82.47 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.981 -177.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.434 HG22 ' HG2' ' A' ' 96' ' ' PRO . 71.5 mt -53.89 -43.62 57.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.471 176.789 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 68.7 m-70 -63.66 -43.88 95.43 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.192 178.784 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 53.6 mt -64.59 -49.37 71.4 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.138 -175.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -56.48 -50.87 70.5 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.205 179.151 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.97 -41.64 98.24 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.049 -179.686 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 50.5 tptt -59.53 -45.33 92.07 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.463 -179.534 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.18 -56.18 21.26 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.636 179.099 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 71.0 mt -57.67 -37.08 57.18 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.481 -179.461 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.457 ' HA ' ' HB ' ' A' ' 71' ' ' ILE . 86.1 t80 -58.38 -60.82 3.19 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.54 -179.446 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -82.87 -1.05 50.99 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.911 -171.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 57.5 tptt -105.82 -31.76 8.69 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.748 -0.206 . . . . 0.0 111.008 178.238 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 81.2 m-85 -130.01 -43.5 1.2 Allowed 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 112.506 0.558 . . . . 0.0 112.506 -172.242 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.457 ' HB ' ' HA ' ' A' ' 67' ' ' TYR . 48.2 mm -77.93 -32.88 17.92 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.458 0 CA-C-O 121.046 0.451 . . . . 0.0 111.711 -173.477 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.546 ' HB3' ' HB2' ' A' ' 75' ' ' ALA . 7.0 tp60 -77.02 144.49 38.62 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.196 -173.824 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 89.4 m -71.64 -34.98 70.24 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.826 -178.37 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.407 ' H ' ' HG3' ' A' ' 72' ' ' GLN . 3.1 p30 -87.73 10.58 17.82 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 120.91 0.386 . . . . 0.0 110.747 177.21 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.546 ' HB2' ' HB3' ' A' ' 72' ' ' GLN . . . -69.91 154.11 94.93 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.528 179.15 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_exo -55.18 -28.69 62.66 Favored 'Trans proline' 0 C--N 1.348 0.54 0 C-N-CA 122.668 2.245 . . . . 0.0 112.25 178.536 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 17.9 tppt? -107.3 -69.51 0.84 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.488 -178.095 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 63.07 108.17 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.273 0.559 . . . . 0.0 110.023 -170.48 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 48.9 t -93.9 155.61 3.17 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.357 -176.515 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.486 ' HB2' HD21 ' A' ' 111' ' ' LEU . 45.0 m-80 -78.02 48.45 0.72 Allowed 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.238 0.542 . . . . 0.0 110.8 -179.746 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.416 HD11 HG21 ' A' ' 85' ' ' THR . 23.4 tp -79.45 151.7 30.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.382 179.291 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -53.88 137.53 38.54 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 116.033 -0.531 . . . . 0.0 111.827 -179.815 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 28.8 p90 -59.02 -45.75 89.94 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.438 -176.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 83.3 t60 -69.9 -30.83 68.36 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.764 0.316 . . . . 0.0 110.675 -176.662 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.416 HG21 HD11 ' A' ' 81' ' ' LEU . 39.3 m -64.8 -50.28 67.35 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.434 179.484 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.426 ' O ' HG23 ' A' ' 90' ' ' THR . 16.0 ptpt -71.66 -24.1 61.79 Favored 'General case' 0 CA--C 1.527 0.077 0 C-N-CA 120.76 -0.376 . . . . 0.0 110.713 -179.568 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 16.0 tp10 -55.52 -53.88 50.83 Favored 'General case' 0 N--CA 1.462 0.161 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 173.512 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 53.1 t -56.77 -45.61 83.03 Favored 'Isoleucine or valine' 0 C--O 1.234 0.254 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.328 178.016 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 71.9 mt -59.4 -47.64 89.92 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.21 -178.527 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.426 HG23 ' O ' ' A' ' 86' ' ' LYS . 66.6 p -62.83 -27.06 69.06 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 120.867 0.365 . . . . 0.0 111.052 -178.173 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 82.3 m-20 -90.87 -14.2 32.21 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.459 -179.033 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 14.4 m -118.04 -0.01 11.74 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 111.804 0.298 . . . . 0.0 111.804 -176.071 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 7.8 tp -59.9 -23.26 26.19 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 CA-C-O 120.802 0.334 . . . . 0.0 111.337 -177.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . 0.569 HG23 ' HG2' ' A' ' 95' ' ' GLN . 5.9 t -59.79 -32.71 70.86 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.855 178.749 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.569 ' HG2' HG23 ' A' ' 94' ' ' THR . 11.7 pt20 -165.05 93.02 0.92 Allowed Pre-proline 0 CA--C 1.533 0.32 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.051 177.443 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.434 ' HG2' HG22 ' A' ' 59' ' ' ILE . 94.2 Cg_endo -81.8 158.24 18.61 Favored 'Trans proline' 0 C--N 1.346 0.421 0 C-N-CA 122.82 2.347 . . . . 0.0 112.594 -178.719 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 25.0 p -84.28 173.83 10.66 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.955 177.725 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . 0.488 ' H ' HD22 ' A' ' 98' ' ' LEU . 3.4 mm? -49.62 -43.77 46.85 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 123.208 0.603 . . . . 0.0 112.485 -172.87 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 -129.11 28.74 5.25 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.208 -173.588 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 6.3 p -46.09 -36.15 5.56 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 112.967 0.729 . . . . 0.0 112.967 -173.685 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -82.06 18.81 1.26 Allowed 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 111.999 0.37 . . . . 0.0 111.999 -177.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -70.64 -37.76 73.78 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 121.13 0.49 . . . . 0.0 109.899 179.028 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . 0.439 ' O ' ' HG2' ' A' ' 107' ' ' ARG . . . -61.72 -46.04 91.38 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.774 -0.648 . . . . 0.0 109.724 175.448 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -61.28 -40.99 96.16 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.493 178.278 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.51 ' HG3' ' HB2' ' A' ' 44' ' ' TRP . 30.4 tt0 -57.83 -45.82 85.63 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.621 177.663 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 18.5 m -63.27 -43.64 97.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.83 -179.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . 0.439 ' HG2' ' O ' ' A' ' 103' ' ' ALA . 20.5 mmt180 -58.14 -53.51 57.49 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.917 179.207 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.437 ' O ' ' SD ' ' A' ' 112' ' ' MET . 99.5 t -69.11 -35.9 70.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.457 -175.794 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . 0.41 ' HA ' ' HE1' ' A' ' 112' ' ' MET . 67.7 t80 -53.8 -54.55 36.72 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.031 0.444 . . . . 0.0 110.826 179.092 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 26.6 pt20 -73.85 -20.15 60.52 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.829 179.235 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.486 HD21 ' HB2' ' A' ' 80' ' ' ASN . 35.6 tp -61.58 -49.66 75.74 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.257 -176.814 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . 0.505 ' HE3' ' HE1' ' A' ' 44' ' ' TRP . 0.0 OUTLIER -83.5 -29.63 27.81 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 120.312 -0.555 . . . . 0.0 110.263 177.529 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . 0.644 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 40.1 tt0 -52.36 -53.38 45.49 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 120.936 0.398 . . . . 0.0 110.721 179.188 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . 0.412 ' HG2' ' O ' ' A' ' 111' ' ' LEU . 29.8 pt20 -52.58 -18.95 1.98 Allowed 'General case' 0 N--CA 1.468 0.474 0 N-CA-C 113.623 0.971 . . . . 0.0 113.623 -170.638 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . 0.583 ' O ' ' HG3' ' A' ' 119' ' ' ARG . 35.5 t70 -141.84 -52.86 0.43 Allowed 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 118.087 0.403 . . . . 0.0 111.68 -178.715 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 22.6 m -59.83 -31.76 70.03 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-O 120.665 0.269 . . . . 0.0 111.252 -178.801 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . 0.644 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 16.1 t80 -71.4 -42.75 67.94 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-O 120.647 0.261 . . . . 0.0 110.451 179.795 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 7.8 p -65.99 -35.54 80.87 Favored 'General case' 0 C--O 1.24 0.585 0 CA-C-N 116.496 -0.32 . . . . 0.0 110.635 178.509 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . 0.583 ' HG3' ' O ' ' A' ' 115' ' ' ASP . 95.4 mtt180 -54.42 -51.13 65.9 Favored 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 172.266 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 79.6 t80 -58.39 -38.67 77.78 Favored 'General case' 0 C--O 1.225 -0.211 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.42 179.257 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.439 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 68.4 mt -62.95 -23.34 67.36 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.595 -179.272 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 2.4 tppp? -118.69 12.27 13.01 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.099 0.476 . . . . 0.0 111.311 177.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 95.2 p -71.17 146.81 48.88 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 176.245 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -56.48 -30.39 62.88 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 176.752 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . 0.424 ' O ' ' HG ' ' A' ' 129' ' ' LEU . 78.5 mt -56.94 -54.51 29.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 CA-C-N 115.138 -0.937 . . . . 0.0 110.335 175.712 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' TYR . . . . . 0.482 ' O ' ' HG2' ' A' ' 130' ' ' MET . 75.7 t80 -64.1 -38.23 90.3 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.442 -178.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 92.4 mt -61.87 -36.1 80.25 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.166 177.535 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -70.6 -32.51 69.9 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.112 176.841 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . 0.424 ' HG ' ' O ' ' A' ' 125' ' ' ILE . 95.9 mt -72.29 -26.82 62.11 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.503 176.43 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' MET . . . . . 0.484 ' O ' ' HB2' ' A' ' 131' ' ' GLU . 27.2 mmt -67.44 -64.64 0.82 Allowed 'General case' 0 C--O 1.232 0.167 0 N-CA-C 109.658 -0.497 . . . . 0.0 109.658 176.089 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . 0.484 ' HB2' ' O ' ' A' ' 130' ' ' MET . 1.6 tm-20 170.49 -73.41 0.0 OUTLIER 'General case' 0 C--O 1.233 0.196 0 N-CA-C 108.261 -1.015 . . . . 0.0 108.261 179.3 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 167.57 -54.56 0.23 Allowed Glycine 0 N--CA 1.45 -0.431 0 N-CA-C 110.802 -0.919 . . . . 0.0 110.802 -178.576 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . . . . . . . . . 4.3 ptp85 -146.83 91.64 5.19 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 120.67 0.271 . . . . 0.0 110.965 177.274 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo . . . . . 0 C--N 1.349 0.554 0 C-N-CA 122.382 2.055 . . . . 0.0 110.817 172.962 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 7.2 m . . . . . 0 N--CA 1.477 0.898 0 CA-C-O 120.749 0.309 . . . . 0.0 110.563 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 27.3 ttt -148.74 104.19 3.45 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 179.259 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.49 HG21 ' CH2' ' A' ' 11' ' ' TRP . 2.6 p -125.65 146.09 31.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.973 -178.042 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 34.4 m -114.6 155.75 45.65 Favored Pre-proline 0 C--N 1.328 -0.364 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.645 177.117 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 80.5 Cg_exo -49.25 -37.11 39.05 Favored 'Trans proline' 0 C--N 1.353 0.814 0 C-N-CA 122.91 2.407 . . . . 0.0 112.742 -178.401 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.448 ' O ' HG22 ' A' ' 9' ' ' VAL . 5.3 mp0 -64.62 -36.32 83.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.857 179.333 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.456 ' HB3' HG23 ' A' ' 3' ' ' VAL . 25.8 tp10 -68.37 -36.03 78.6 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 175.765 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.93 -41.38 91.43 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.338 179.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.448 HG22 ' O ' ' A' ' 6' ' ' GLU . 19.4 m -70.55 -23.24 24.19 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.281 0 CA-C-O 120.895 0.378 . . . . 0.0 110.29 178.717 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.48 ' O ' ' HD2' ' A' ' 17' ' ' LYS . 67.4 mmtt -67.13 -39.34 86.61 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-O 121.077 0.465 . . . . 0.0 109.847 171.68 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . 0.49 ' CH2' HG21 ' A' ' 3' ' ' VAL . 47.1 m0 -62.74 -27.09 69.04 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 175.075 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -72.42 -31.77 62.96 Favored Glycine 0 CA--C 1.52 0.358 0 CA-C-N 115.392 -0.822 . . . . 0.0 112.911 178.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' A' ' 10' ' ' LYS . 11.5 pt-20 -82.56 -23.11 34.65 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 117.147 0.474 . . . . 0.0 111.162 -178.941 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.522 ' HB2' ' HG2' ' A' ' 17' ' ' LYS . 49.8 m -152.22 107.68 3.3 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 112.123 0.416 . . . . 0.0 112.123 -179.619 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.474 ' CD1' HD23 ' A' ' 18' ' ' LEU . 40.2 t80 -53.65 -27.42 27.3 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.55 175.49 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -59.2 -54.11 50.61 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.328 177.43 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.522 ' HG2' ' HB2' ' A' ' 14' ' ' SER . 17.7 ptpt -71.56 -20.08 62.07 Favored 'General case' 0 N--CA 1.464 0.244 0 C-N-CA 120.937 -0.305 . . . . 0.0 110.599 -175.121 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.476 ' O ' ' HA3' ' A' ' 24' ' ' GLY . 48.9 tp -59.01 -48.95 79.75 Favored 'General case' 0 N--CA 1.463 0.183 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 169.656 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.503 HD23 ' CZ2' ' A' ' 44' ' ' TRP . 0.8 OUTLIER -77.44 -27.52 52.22 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.948 -179.539 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.5 ' HB3' ' HA ' ' A' ' 17' ' ' LYS . 9.7 t -74.61 -25.08 59.01 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.508 -178.125 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -92.15 126.79 37.38 Favored 'General case' 0 C--O 1.232 0.179 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 177.784 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 36.2 ttm180 -51.6 -39.71 58.49 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 120.739 0.304 . . . . 0.0 110.569 179.355 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -61.73 -40.55 95.47 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.051 179.212 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.476 ' HA3' ' O ' ' A' ' 18' ' ' LEU . . . -68.11 -48.94 50.43 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.855 -0.688 . . . . 0.0 111.517 -179.416 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 7.8 tt -58.23 -38.66 77.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.025 0.441 . . . . 0.0 110.07 174.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -61.22 -51.71 67.82 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.379 179.234 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -68.73 -32.95 73.1 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.916 179.468 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -73.73 -37.59 65.05 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.951 -176.284 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.457 ' O ' ' HB2' ' A' ' 33' ' ' LYS . 11.2 t -71.23 -44.39 65.43 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 121.027 -0.269 . . . . 0.0 110.58 -178.816 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 11.8 ptm180 -64.71 -32.73 74.53 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 120.847 0.356 . . . . 0.0 110.39 178.842 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 85.7 t80 -70.29 -55.73 8.48 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.205 177.338 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.443 HD23 ' HA ' ' A' ' 38' ' ' GLU . 25.5 tp -67.02 -16.5 64.4 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.996 -176.877 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.457 ' HB2' ' O ' ' A' ' 29' ' ' THR . 22.3 ttmm -69.6 -18.82 63.65 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.699 178.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 13.9 t -56.61 -26.32 55.35 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.038 0.447 . . . . 0.0 111.215 -179.145 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -124.59 8.12 8.28 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.39 179.376 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 53.37 41.22 32.14 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 115.488 -0.778 . . . . 0.0 111.583 176.761 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 50.5 m -107.49 20.51 18.8 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.937 179.551 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.443 ' HA ' HD23 ' A' ' 32' ' ' LEU . 6.6 pt-20 -69.3 -6.94 32.73 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.035 178.684 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -42.73 -38.4 2.07 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.049 171.113 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.529 ' O ' ' HB3' ' A' ' 43' ' ' PHE . 50.0 m-80 -64.75 -57.83 7.89 Favored 'General case' 0 C--O 1.245 0.831 0 CA-C-N 115.324 -0.853 . . . . 0.0 111.568 -176.117 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.432 ' O ' HG13 ' A' ' 45' ' ' ILE . 9.8 tt -60.9 -41.05 87.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.13 -0.486 . . . . 0.0 109.822 -177.85 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.529 ' HA ' ' HB ' ' A' ' 45' ' ' ILE . 53.7 mt-10 -67.14 -30.14 70.05 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.859 178.213 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.529 ' HB3' ' O ' ' A' ' 40' ' ' ASN . 81.4 t80 -54.49 -60.71 2.99 Favored 'General case' 0 C--O 1.238 0.488 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.559 179.16 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' TRP . . . . . 0.626 ' HA ' ' SG ' ' A' ' 47' ' ' CYS . 26.4 p-90 -79.8 -14.51 58.64 Favored 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 119.357 -0.937 . . . . 0.0 111.614 -178.645 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.529 ' HB ' ' HA ' ' A' ' 42' ' ' GLU . 18.4 mt -62.99 -38.72 82.75 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 168.612 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.93 -36.27 82.91 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.811 -0.631 . . . . 0.0 109.872 174.226 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.626 ' SG ' ' HA ' ' A' ' 44' ' ' TRP . 64.3 m -61.51 -31.08 71.06 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.726 176.566 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.501 ' HG2' ' O ' ' A' ' 44' ' ' TRP . 9.2 mm-40 -73.82 -38.21 64.62 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 120.968 0.413 . . . . 0.0 109.899 176.398 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -57.74 -35.95 71.4 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 121.409 0.623 . . . . 0.0 109.9 174.446 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' PHE . . . . . . . . . . . . . 51.0 t80 -72.46 -45.28 60.23 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 114.862 -1.063 . . . . 0.0 110.398 174.371 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.464 ' HB3' ' HA ' ' A' ' 48' ' ' GLU . 4.1 tmtm? -54.73 -38.27 66.92 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.635 -0.711 . . . . 0.0 112.502 -176.631 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 22.9 pttm -72.74 -21.19 61.06 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.043 0.449 . . . . 0.0 110.792 -176.318 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 22.7 m -81.46 75.79 8.41 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.187 -177.427 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.88 -5.99 42.03 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.943 -176.07 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -73.65 125.96 9.55 Favored Glycine 0 CA--C 1.521 0.414 0 C-N-CA 121.142 -0.552 . . . . 0.0 112.258 177.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.444 ' O ' ' HD2' ' A' ' 60' ' ' HIS . 89.0 Cg_exo -48.0 -46.53 21.75 Favored 'Trans proline' 0 C--N 1.352 0.714 0 C-N-CA 123.037 2.491 . . . . 0.0 112.84 -177.201 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -63.12 -42.3 99.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.625 -179.325 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 13.9 mm100 -64.08 -36.7 84.88 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.578 -177.515 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 30.6 mm -51.96 -55.92 7.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.298 179.111 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.444 ' HD2' ' O ' ' A' ' 56' ' ' PRO . 61.2 m-70 -62.89 -38.76 92.18 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.947 -175.701 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 88.6 mt -69.16 -55.16 11.49 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.012 -178.069 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.478 ' HE2' ' HA ' ' A' ' 62' ' ' LYS . 7.4 mmpt? -59.83 -40.09 87.31 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.013 -178.201 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.12 -46.86 84.85 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.771 178.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 4.2 tppp? -66.04 -32.2 73.54 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.79 -179.63 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -62.03 -59.16 5.49 Favored 'General case' 0 C--O 1.238 0.483 0 CA-C-O 120.945 0.403 . . . . 0.0 110.25 177.565 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 65.5 mt -59.52 -35.19 57.62 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.331 178.315 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.403 ' CE1' HG22 ' A' ' 90' ' ' THR . 77.2 t80 -54.17 -63.22 1.22 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.944 -179.713 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -79.35 -9.6 59.62 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 0.0 112.185 -172.787 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 56.1 tptt -98.02 -33.34 11.22 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 111.627 0.232 . . . . 0.0 111.627 -179.743 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 69.9 m-85 -128.05 -43.86 1.48 Allowed 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -173.34 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 49.6 mm -67.82 -40.49 83.75 Favored 'Isoleucine or valine' 0 C--O 1.238 0.468 0 CA-C-O 120.912 0.387 . . . . 0.0 111.185 -173.853 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.596 ' HB2' ' HB2' ' A' ' 75' ' ' ALA . 15.8 mm100 -60.59 141.53 56.55 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.541 178.119 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 92.4 m -67.13 -53.25 32.36 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.543 -179.477 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -88.95 27.9 1.27 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.631 -179.506 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.596 ' HB2' ' HB2' ' A' ' 72' ' ' GLN . . . -62.28 160.04 35.27 Favored Pre-proline 0 CA--C 1.531 0.247 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.0 178.358 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -72.19 48.05 1.14 Allowed 'Trans proline' 0 CA--C 1.538 0.72 0 C-N-CA 123.136 2.557 . . . . 0.0 112.48 176.249 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -178.92 -59.0 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 108.095 -1.076 . . . . 0.0 108.095 178.07 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 69.86 126.48 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.756 -177.439 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 57.8 t -121.04 138.2 52.24 Favored 'Isoleucine or valine' 0 C--O 1.237 0.422 0 CA-C-N 116.106 -0.497 . . . . 0.0 109.935 177.189 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 37.1 m-80 -75.08 86.05 2.35 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.509 0.671 . . . . 0.0 111.075 179.567 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 15.1 tp -125.58 151.92 45.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.102 -0.953 . . . . 0.0 109.974 178.395 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -57.49 135.37 56.61 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.923 -0.581 . . . . 0.0 111.397 179.293 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 81.6 m-85 -67.68 -42.65 81.75 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.06 -175.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 72.7 t60 -58.62 -31.89 68.52 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.965 0.412 . . . . 0.0 110.381 178.285 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 37.7 m -66.97 -46.54 74.32 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.741 178.346 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -69.68 -24.99 63.67 Favored 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 120.692 -0.403 . . . . 0.0 110.226 -179.419 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -59.24 -52.41 65.79 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.392 0.615 . . . . 0.0 109.892 174.504 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 91.6 t -59.52 -39.28 78.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.027 177.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 81.5 mt -63.41 -43.8 98.65 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.04 179.107 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.403 HG22 ' CE1' ' A' ' 67' ' ' TYR . 33.7 p -65.09 -23.68 67.23 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-O 120.828 0.347 . . . . 0.0 111.097 -178.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 39.2 m-80 -86.92 -21.76 26.09 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.897 176.065 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 28.2 t -99.35 -9.49 23.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.29 -177.345 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 10.4 tp -58.16 -26.29 29.03 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 CA-C-O 120.783 0.325 . . . . 0.0 111.665 -175.771 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 6.0 t -62.95 -44.59 95.66 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.103 -179.835 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -148.62 79.9 8.52 Favored Pre-proline 0 N--CA 1.464 0.225 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 179.853 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -84.73 155.11 11.76 Favored 'Trans proline' 0 N--CA 1.46 -0.454 0 C-N-CA 122.579 2.186 . . . . 0.0 112.104 179.164 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 25.2 p -89.63 169.67 11.12 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.387 175.675 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 9.0 mp -53.28 -27.79 24.57 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 122.818 0.447 . . . . 0.0 112.043 -175.396 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' HIS . . . . . 0.463 ' HD2' ' HB2' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -131.02 44.01 3.02 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.101 0.477 . . . . 0.0 110.118 177.224 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 34.7 t -57.49 -34.47 69.08 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 115.705 -0.68 . . . . 0.0 110.471 176.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 85.7 m-85 -81.88 14.68 2.59 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 115.683 -0.689 . . . . 0.0 111.367 -178.322 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' ASP . . . . . 0.414 ' HB2' ' O ' ' A' ' 99' ' ' HIS . 12.8 t70 -57.83 -44.2 86.32 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 120.831 0.348 . . . . 0.0 110.537 -178.725 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -60.34 -43.05 96.82 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-O 121.06 0.457 . . . . 0.0 110.751 177.511 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -63.68 -37.85 88.92 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.828 -0.623 . . . . 0.0 110.168 178.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.611 HE21 ' HB2' ' A' ' 44' ' ' TRP . 34.3 tt0 -63.7 -45.05 91.74 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.137 178.232 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 36.5 m -57.74 -47.19 83.17 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.358 177.611 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 23.0 mmt180 -52.71 -62.66 1.51 Allowed 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.947 178.297 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.436 HG13 ' HB3' ' A' ' 40' ' ' ASN . 80.8 t -60.23 -42.6 90.99 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.449 -176.118 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 49.9 t80 -56.44 -51.88 66.74 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.095 -178.246 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' GLN . . . . . . . . . . . . . 5.2 pp0? -73.45 -23.9 60.16 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 116.785 -0.189 . . . . 0.0 111.427 -176.87 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 61.7 mt -67.61 -49.14 64.5 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-O 120.82 0.343 . . . . 0.0 110.235 175.637 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' MET . . . . . . . . . . . . . 49.7 mtm -64.34 -36.48 84.27 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 116.158 -0.474 . . . . 0.0 109.886 178.061 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . 0.595 ' O ' ' HB3' ' A' ' 117' ' ' TYR . 44.7 tt0 -55.74 -65.69 0.55 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.631 179.64 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 11.5 pt20 -62.0 -15.64 45.64 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 113.034 0.753 . . . . 0.0 113.034 -171.938 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -121.84 -61.95 1.45 Allowed 'General case' 0 N--CA 1.466 0.33 0 O-C-N 121.979 -0.45 . . . . 0.0 112.059 -176.002 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 2.6 m -68.74 -39.09 80.5 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.886 -177.018 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' TYR . . . . . 0.595 ' HB3' ' O ' ' A' ' 113' ' ' GLU . 36.1 t80 -78.24 -37.81 44.42 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.986 -173.831 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 21.1 p -61.05 -48.94 79.4 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-O 121.219 0.533 . . . . 0.0 110.111 176.342 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . . . . . . . . . 65.5 mtm180 -64.62 -34.33 78.02 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.39 176.236 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -61.27 -37.6 83.75 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.623 177.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.416 ' HG ' ' O ' ' A' ' 117' ' ' TYR . 95.4 mt -63.66 -44.93 92.34 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.203 0.525 . . . . 0.0 110.606 177.546 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 23.0 tptp -92.13 5.02 51.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.696 -174.016 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 85.3 p -69.09 141.19 54.78 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.786 0.327 . . . . 0.0 110.918 178.84 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -56.07 -32.7 64.34 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.042 177.202 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -65.76 -36.86 78.58 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.237 179.592 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -74.44 -38.0 63.12 Favored 'General case' 0 C--O 1.233 0.192 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 177.059 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 95.8 mt -61.75 -28.43 69.43 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 116.049 -0.523 . . . . 0.0 109.972 175.836 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -69.4 -41.7 76.08 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.086 173.585 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 98.1 mt -63.41 -25.68 68.39 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.569 178.302 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' MET . . . . . . . . . . . . . 28.8 mmt -77.64 -54.41 6.42 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.247 175.249 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 54.32 37.37 27.33 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 121.868 0.842 . . . . 0.0 109.677 -178.289 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' GLY . . . . . . . . . . . . . . . 102.1 -66.29 0.42 Allowed Glycine 0 N--CA 1.45 -0.388 0 N-CA-C 110.681 -0.968 . . . . 0.0 110.681 -174.468 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' ARG . . . . . 0.543 ' HD2' ' O ' ' A' ' 134' ' ' PRO . 6.8 tmm_? 60.99 111.94 0.02 OUTLIER Pre-proline 0 CA--C 1.539 0.557 0 C-N-CA 123.399 0.68 . . . . 0.0 111.369 174.879 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' PRO . . . . . 0.543 ' O ' ' HD2' ' A' ' 133' ' ' ARG . 75.3 Cg_exo . . . . . 0 C--N 1.354 0.863 0 C-N-CA 123.035 2.49 . . . . 0.0 112.862 179.738 . . . . . . . . 1 1 . 1 stop_ save_