data_1qgb_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 1qgb _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo . . . . . 0 C--O 1.231 0.15 0 CA-C-O 120.868 0.278 . . . . 0.0 112.432 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 119.11 177.17 16.48 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.513 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -143.1 107.19 4.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.821 0.343 . . . . 0.0 111.046 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -96.37 118.16 32.34 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.691 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.4 ' OD2' ' CD ' ' A' ' 36' ' ' ARG . 0.2 OUTLIER -149.52 149.69 31.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.963 -179.944 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 39.8 t30 47.14 30.12 1.3 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.95 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 71.36 16.87 75.7 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.546 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.44 ' HB3' ' CZ ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -115.14 155.74 26.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.821 0.343 . . . . 0.0 110.823 -179.991 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 18.6 t-80 -111.38 83.97 1.86 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.151 -179.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.44 ' CZ ' ' HB3' ' A' ' 26' ' ' LYS . 0.9 OUTLIER -82.6 173.68 11.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.784 179.746 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.524 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 1.0 OUTLIER -109.74 140.92 43.07 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.596 179.709 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.503 ' CG2' ' HA2' ' A' ' 49' ' ' GLY . 4.0 mp -36.47 151.62 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.207 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.446 ' HB2' ' O ' ' A' ' 30' ' ' ILE . 29.7 m-80 66.53 13.22 9.19 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.789 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.524 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 13.4 tt0 -100.46 149.16 23.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.844 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.454 ' HG2' ' OG1' ' A' ' 46' ' ' THR . 10.9 mt-30 -115.99 143.93 44.77 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.178 -179.715 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . 0.571 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 37.6 p90 -145.69 162.43 37.57 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.6 179.616 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -100.0 128.19 46.11 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.979 0.419 . . . . 0.0 111.439 -179.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.4 ' CD ' ' OD2' ' A' ' 23' ' ' ASP . 0.0 OUTLIER -132.2 -163.26 1.31 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.278 179.527 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.467 ' HA ' ' O ' ' A' ' 41' ' ' ASN . 1.2 t -147.46 134.73 20.6 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.822 0.344 . . . . 0.0 111.244 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.523 ' HB2' ' CD2' ' A' ' 43' ' ' LEU . 0.3 OUTLIER -90.02 89.67 7.8 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.486 179.71 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.499 ' CB ' ' O ' ' A' ' 38' ' ' TYR . 1.4 tp 82.89 -48.42 0.16 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.721 -179.729 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . 0.436 ' O ' ' ND2' ' A' ' 41' ' ' ASN . . . 178.53 34.9 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.867 -0.683 . . . . 0.0 112.557 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.467 ' O ' ' HA ' ' A' ' 37' ' ' THR . 25.1 m120 -148.18 148.59 30.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.659 0.266 . . . . 0.0 110.934 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.434 ' C ' ' O ' ' A' ' 41' ' ' ASN . . . -36.53 141.96 0.1 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.695 179.737 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.523 ' CD2' ' HB2' ' A' ' 38' ' ' TYR . 21.9 tp -169.92 99.38 0.3 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.85 0.357 . . . . 0.0 111.27 -179.567 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.509 ' N ' ' O ' ' A' ' 57' ' ' GLU . 24.8 t -75.92 159.53 5.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.569 179.492 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.571 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 0.0 OUTLIER -140.77 144.91 35.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.856 0.36 . . . . 0.0 111.266 -179.769 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.454 ' OG1' ' HG2' ' A' ' 33' ' ' GLN . 86.1 m -129.66 123.48 31.31 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.915 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.464 ' SG ' ' HA ' ' A' ' 30' ' ' ILE . 30.3 t -80.63 137.61 36.36 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.002 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.437 ' CE1' ' O ' ' A' ' 46' ' ' THR . 5.5 m-85 -117.05 -2.27 11.75 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.975 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.503 ' HA2' ' CG2' ' A' ' 30' ' ' ILE . . . 135.02 -173.62 21.51 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.438 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -85.13 -11.12 76.79 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.485 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -109.49 -44.32 3.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.819 0.342 . . . . 0.0 110.954 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 3.9 mtt180 -73.38 -29.39 62.59 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.049 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 75.26 -156.45 48.68 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.549 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.534 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 12.1 p90 -134.07 150.0 51.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.889 0.376 . . . . 0.0 110.952 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -120.46 104.39 9.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.839 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.467 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 1.2 m -67.48 163.78 20.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.936 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . 0.509 ' O ' ' N ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -166.6 142.34 4.53 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.862 179.889 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.426 ' O ' ' C ' ' A' ' 59' ' ' LYS . 3.4 m -69.38 146.49 52.05 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.879 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.426 ' C ' ' O ' ' A' ' 58' ' ' SER . 0.9 OUTLIER . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.871 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.509 ' O ' ' CB ' ' A' ' 64' ' ' GLU . 3.0 tt0 . . . . . 0 N--CA 1.455 -0.183 0 CA-C-O 120.729 0.3 . . . . 0.0 110.572 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.509 ' CB ' ' O ' ' A' ' 63' ' ' GLU . 3.6 mt-10 159.37 63.05 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.078 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.434 HG21 ' O ' ' A' ' 64' ' ' GLU . 0.1 OUTLIER 170.66 154.54 0.06 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.13 179.958 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 17.8 m -126.07 -154.55 0.63 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.835 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.406 ' O ' ' N ' ' A' ' 73' ' ' ASN . 44.6 t80 -158.3 -40.31 0.06 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.024 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . 0.515 ' O ' ' N ' ' A' ' 72' ' ' GLY . 3.7 t0 71.01 70.07 0.18 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.968 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -43.05 -29.41 0.35 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.915 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . 0.561 ' CE2' ' HE3' ' A' ' 85' ' ' LYS . 7.5 m-30 -53.28 -54.18 40.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.947 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 25.4 m -119.97 -36.5 3.26 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.072 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . 0.515 ' N ' ' O ' ' A' ' 68' ' ' ASP . . . 97.79 47.71 2.06 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.439 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . 0.473 ' HB3' ' CZ ' ' A' ' 75' ' ' TYR . 0.4 OUTLIER -96.77 -172.56 2.5 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.787 0.327 . . . . 0.0 110.844 -179.979 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' THR . . . . . 0.491 ' O ' ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -120.78 117.99 28.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.016 179.913 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.491 ' CD1' ' O ' ' A' ' 74' ' ' THR . 9.6 m-85 -136.87 144.75 43.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.906 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -83.53 165.19 19.31 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.961 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.454 HG11 ' HA ' ' A' ' 64' ' ' GLU . 13.5 p -81.11 -18.46 11.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.169 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -100.92 42.96 1.82 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.509 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -164.21 133.1 3.7 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.813 0.34 . . . . 0.0 110.964 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 58.2 p -93.6 163.72 13.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.187 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 33.2 p90 -160.65 110.7 1.75 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.856 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -55.5 160.5 2.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.021 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.403 ' HA ' ' HD2' ' A' ' 84' ' ' PRO . 0.0 OUTLIER -148.91 96.59 3.75 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.8 179.888 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.403 ' HD2' ' HA ' ' A' ' 83' ' ' ARG . 36.8 Cg_endo -65.79 114.91 3.14 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.769 2.312 . . . . 0.0 112.333 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.561 ' HE3' ' CE2' ' A' ' 70' ' ' TYR . 0.5 OUTLIER -141.67 111.14 6.46 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.839 -179.978 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.454 ' CB ' ' O ' ' A' ' 85' ' ' LYS . 0.9 OUTLIER 80.65 -159.16 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.768 -179.963 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' SER . . . . . 0.445 ' O ' ' OG ' ' A' ' 87' ' ' SER . 2.3 t -89.85 17.32 6.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.919 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' MET . . . . . 0.563 ' HG2' ' CZ2' ' A' ' 90' ' ' TRP . 16.5 tpp -131.61 129.74 41.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.829 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -92.03 139.29 18.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.177 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' TRP . . . . . 0.563 ' CZ2' ' HG2' ' A' ' 88' ' ' MET . 1.7 m95 -136.4 152.21 50.37 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.823 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -104.89 87.65 2.71 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.842 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 73.2 m -67.26 140.71 57.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.013 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' THR . . . . . 0.503 ' O ' ' N ' ' A' ' 95' ' ' ILE . 86.6 m -123.94 122.53 38.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.127 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . 0.425 ' SG ' ' HB2' ' A' ' 75' ' ' TYR . 0.0 OUTLIER -63.08 69.65 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.798 -179.993 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.503 ' N ' ' O ' ' A' ' 93' ' ' THR . 1.2 mt -89.64 46.89 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.353 -179.845 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.446 ' HA2' ' HA2' ' A' ' 100' ' ' GLY . . . -52.4 -81.59 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.484 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.411 ' HA ' ' HG3' ' A' ' 63' ' ' GLU . . . 61.38 -89.05 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.811 0.338 . . . . 0.0 111.098 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -71.11 -30.59 67.39 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.488 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 9.1 ttt180 -174.87 -67.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.846 0.355 . . . . 0.0 110.923 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . 0.446 ' HA2' ' HA2' ' A' ' 96' ' ' GLY . . . -167.84 91.05 0.1 OUTLIER Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.486 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 4.5 ttt85 -109.25 42.28 1.48 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.808 0.337 . . . . 0.0 110.971 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 1.2 mp -52.55 95.9 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.193 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 47.5 t -86.48 123.53 31.8 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.913 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 46.2 m -116.02 101.03 8.38 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.844 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' THR . . . . . 0.43 HG23 ' O ' ' A' ' 105' ' ' THR . 14.0 t -110.98 142.14 43.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.133 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.527 HD11 ' CZ3' ' A' ' 90' ' ' TRP . 4.6 mp -44.26 149.05 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.987 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -49.09 139.9 10.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.881 0.372 . . . . 0.0 111.104 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -68.23 -33.28 74.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.897 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.228 -0.891 . . . . 0.0 110.938 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_exo . . . . . 0 C--O 1.231 0.137 0 CA-C-O 120.814 0.256 . . . . 0.0 112.262 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.37 162.82 3.28 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.665 -0.779 . . . . 0.0 112.474 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 25.0 m -127.4 106.85 9.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.87 0.367 . . . . 0.0 110.846 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 32.6 t80 -86.25 120.87 28.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.985 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.452 ' OD1' ' CB ' ' A' ' 26' ' ' LYS . 3.6 p-10 -97.42 -160.29 0.79 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.866 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.429 ' C ' ' O ' ' A' ' 23' ' ' ASP . 0.4 OUTLIER -34.96 -75.67 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.976 -0.557 . . . . 0.0 111.008 -179.983 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -133.64 33.78 2.51 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.632 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.513 ' HB3' ' CE2' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -140.16 141.17 36.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.836 0.351 . . . . 0.0 110.969 -179.997 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 10.4 t-160 -120.44 90.14 3.27 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.968 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.625 ' CE2' ' CB ' ' A' ' 34' ' ' TRP . 93.1 m-85 -87.26 161.64 17.88 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.094 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.532 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 3.6 tt0 -87.56 156.38 19.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.803 179.829 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.508 ' CG2' ' HA3' ' A' ' 49' ' ' GLY . 3.9 mp -44.45 147.73 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.437 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 24.0 m-80 65.03 13.43 8.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.162 179.704 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.532 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 1.0 OUTLIER -99.74 148.6 24.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.879 0.371 . . . . 0.0 110.781 179.851 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.416 ' CG ' HG22 ' A' ' 46' ' ' THR . 25.6 mt-30 -115.96 151.0 36.25 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.913 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . 0.625 ' CB ' ' CE2' ' A' ' 28' ' ' TYR . 42.6 p90 -152.65 -174.45 4.92 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.902 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -114.61 132.45 56.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.019 -179.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.529 ' O ' ' CB ' ' A' ' 43' ' ' LEU . 3.1 ttt180 -139.22 165.92 25.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.725 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.401 ' OG1' ' C ' ' A' ' 41' ' ' ASN . 2.2 t -136.92 135.9 38.15 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.917 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.528 ' CD1' HD12 ' A' ' 39' ' ' LEU . 1.1 t80 -118.37 125.32 49.76 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.773 179.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.528 HD12 ' CD1' ' A' ' 38' ' ' TYR . 0.8 OUTLIER 65.36 14.42 9.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.605 -179.737 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 87.45 44.61 5.51 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.58 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.427 ' O ' ' C ' ' A' ' 42' ' ' ALA . 27.2 m-80 -144.09 125.5 14.8 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.751 0.31 . . . . 0.0 110.89 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.459 ' O ' ' CD1' ' A' ' 43' ' ' LEU . . . -35.04 147.57 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.945 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.529 ' CB ' ' O ' ' A' ' 36' ' ' ARG . 1.5 tp -165.49 157.78 15.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.988 0.423 . . . . 0.0 111.297 -179.686 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.465 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 3.6 t -126.2 135.46 63.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.335 179.382 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.573 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 0.5 OUTLIER -118.79 162.45 18.45 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.428 -179.486 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.416 HG22 ' CG ' ' A' ' 33' ' ' GLN . 20.5 m -147.69 131.14 16.68 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.895 179.799 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.477 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 14.3 t -91.35 132.26 36.3 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.882 0.372 . . . . 0.0 111.052 -179.85 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.459 ' HB2' ' HB3' ' A' ' 52' ' ' ARG . 2.0 m-85 -105.17 -35.96 7.42 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.783 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.508 ' HA3' ' CG2' ' A' ' 30' ' ' ILE . . . 76.63 173.08 36.63 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.489 -179.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . 0.52 ' O ' ' CB ' ' A' ' 51' ' ' SER . . . 66.91 18.0 68.15 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.64 -0.79 . . . . 0.0 112.532 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' SER . . . . . 0.52 ' CB ' ' O ' ' A' ' 50' ' ' GLY . 1.0 OUTLIER 85.78 -0.56 0.73 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.671 0.272 . . . . 0.0 111.208 179.964 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.465 ' HB2' ' O ' ' A' ' 49' ' ' GLY . 0.0 OUTLIER -56.87 -27.91 61.07 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.937 0.399 . . . . 0.0 110.882 179.942 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 74.45 129.5 0.19 Allowed Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.67 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.559 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 10.3 p90 -63.97 177.63 0.75 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.843 0.354 . . . . 0.0 110.825 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.515 ' ND2' ' O ' ' A' ' 54' ' ' PHE . 29.4 m120 -152.01 123.92 8.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.929 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.465 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.8 OUTLIER -104.56 155.88 18.45 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.908 179.951 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -170.5 171.75 6.31 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.019 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.28 136.44 56.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.932 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.3 tppp? . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.054 179.963 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.455 -0.202 0 CA-C-O 120.781 0.324 . . . . 0.0 110.499 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.49 ' HG3' ' CG2' ' A' ' 77' ' ' VAL . 23.2 tt0 -95.85 57.03 1.78 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.904 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 22.4 p -157.06 -174.97 5.17 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.194 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -144.7 -165.19 2.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.844 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 86.9 t80 -163.83 97.94 0.86 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.819 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . 0.486 ' O ' ' N ' ' A' ' 72' ' ' GLY . 3.9 m-20 -72.26 83.57 1.04 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.962 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -39.41 -30.25 0.06 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.882 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 39.0 m-85 -57.45 -61.69 2.31 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.948 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 24.9 p -112.09 19.51 17.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.105 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . 0.486 ' N ' ' O ' ' A' ' 68' ' ' ASP . . . 38.69 54.96 2.24 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.547 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -124.22 160.19 28.46 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.835 0.35 . . . . 0.0 110.702 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.52 155.81 17.64 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.19 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 25.5 m-85 -139.09 -172.09 3.25 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.836 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -104.83 155.75 18.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.939 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.49 ' CG2' ' HG3' ' A' ' 64' ' ' GLU . 2.5 t -90.63 25.73 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.071 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -138.44 17.85 3.29 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.62 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -142.04 136.71 30.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.819 0.342 . . . . 0.0 110.974 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 1.4 p -93.67 114.08 26.3 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.116 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . 0.505 ' CD1' ' O ' ' A' ' 92' ' ' CYS . 42.5 p90 -102.93 136.47 42.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.883 -179.935 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 90.1 mt-10 -97.37 164.73 12.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.72 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.79 117.68 1.93 Allowed Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.912 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -70.86 103.42 1.34 Allowed 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.671 2.247 . . . . 0.0 112.299 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -134.28 161.65 34.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.986 -179.899 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 51.4 31.08 6.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.932 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 71.34 5.36 5.41 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.087 179.934 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -132.62 178.57 6.74 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.924 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.503 ' C ' ' CD1' ' A' ' 90' ' ' TRP . 1.1 mt -116.67 145.33 22.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.076 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' TRP . . . . . 0.631 ' CZ3' ' CD1' ' A' ' 106' ' ' ILE . 0.0 OUTLIER -144.65 128.56 17.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.908 179.972 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.473 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 3.9 p30 -66.88 95.07 0.35 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.744 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . 0.505 ' O ' ' CD1' ' A' ' 81' ' ' TYR . 64.5 m -79.21 96.17 5.83 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.805 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 2.6 m -74.83 148.45 40.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.017 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . 0.448 ' O ' HG11 ' A' ' 77' ' ' VAL . 0.1 OUTLIER -96.8 51.01 1.13 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.916 -179.923 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.422 HG22 HD13 ' A' ' 95' ' ' ILE . 1.8 mt -44.85 -40.56 2.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.104 -179.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.497 ' O ' ' CB ' ' A' ' 97' ' ' ALA . . . 44.37 -163.08 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.502 179.925 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.497 ' CB ' ' O ' ' A' ' 96' ' ' GLY . . . 83.7 94.84 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.798 0.332 . . . . 0.0 111.075 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 117.67 -62.3 0.42 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.493 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.67 34.59 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.797 0.332 . . . . 0.0 110.88 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . 0.434 ' HA2' ' HA2' ' A' ' 96' ' ' GLY . . . 55.16 79.68 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.556 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.518 ' O ' ' CG ' ' A' ' 101' ' ' ARG . 1.4 tmt_? -106.9 56.77 0.64 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.843 0.354 . . . . 0.0 110.862 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -50.3 139.74 4.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.288 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 12.1 t -115.84 129.69 56.53 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.745 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . 0.432 ' HB3' ' HB2' ' A' ' 90' ' ' TRP . 8.9 m -118.58 143.38 46.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.002 -179.842 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' THR . . . . . 0.468 ' O ' ' HA ' ' A' ' 90' ' ' TRP . 0.3 OUTLIER -151.65 153.77 35.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.039 179.913 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.631 ' CD1' ' CZ3' ' A' ' 90' ' ' TRP . 2.8 mp -59.71 156.6 2.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.311 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . 0.452 ' N ' ' CG2' ' A' ' 106' ' ' ILE . . . 46.51 -178.57 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.292 179.856 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -97.58 40.78 1.14 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.847 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.102 0 CA-C-O 118.299 -0.858 . . . . 0.0 110.91 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.454 ' HB2' HD11 ' A' ' 30' ' ' ILE . 41.6 Cg_endo . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.794 0.248 . . . . 0.0 112.348 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 154.5 -163.13 31.04 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.684 -0.769 . . . . 0.0 112.536 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 80.4 m -139.39 72.65 1.41 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.818 0.342 . . . . 0.0 110.893 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 30.8 t80 -52.5 117.96 3.25 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.815 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -164.86 150.26 9.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.885 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.435 ' O ' ' CG ' ' A' ' 24' ' ' ASN . 28.1 t-20 62.25 26.66 15.98 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.904 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 72.2 11.31 75.23 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.592 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.572 ' HB3' ' CE1' ' A' ' 28' ' ' TYR . 0.4 OUTLIER -122.12 151.59 40.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.814 0.34 . . . . 0.0 110.863 -179.923 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 5.1 t-160 -111.92 89.98 3.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.085 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.572 ' CE1' ' HB3' ' A' ' 26' ' ' LYS . 3.5 m-85 -79.62 171.02 15.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.028 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.529 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 0.9 OUTLIER -111.92 139.26 47.56 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.82 179.915 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.468 ' HA ' ' SG ' ' A' ' 47' ' ' CYS . 3.9 mp -35.0 140.38 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.534 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 13.5 m-20 72.62 8.75 5.65 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.15 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.529 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 56.1 tt0 -97.82 155.24 17.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.849 0.357 . . . . 0.0 111.057 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.517 ' CG ' HG23 ' A' ' 46' ' ' THR . 28.5 mt-30 -118.05 156.99 27.64 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.867 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . 0.57 ' CH2' ' N ' ' A' ' 47' ' ' CYS . 38.2 p90 -155.35 166.95 31.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.707 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -99.77 123.13 43.72 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.169 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.62 -163.91 0.92 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.609 179.754 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.468 ' HA ' ' O ' ' A' ' 41' ' ' ASN . 3.4 t -167.08 32.37 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.353 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.463 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 0.2 OUTLIER -40.33 143.87 0.27 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.847 179.905 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.463 ' HB2' ' O ' ' A' ' 38' ' ' TYR . 2.3 mm? 66.5 16.5 10.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.857 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 66.95 42.07 92.94 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.524 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.468 ' O ' ' HA ' ' A' ' 37' ' ' THR . 51.6 m-80 -152.23 132.11 13.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.596 0.236 . . . . 0.0 110.781 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.459 ' O ' HD13 ' A' ' 43' ' ' LEU . . . -31.01 135.1 0.06 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.458 -179.761 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.51 ' CD2' ' HB3' ' A' ' 56' ' ' CYS . 0.7 OUTLIER -153.86 174.66 14.3 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.13 -179.732 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.489 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.6 t -144.88 127.05 9.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.478 179.541 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.574 ' SG ' ' CD1' ' A' ' 54' ' ' PHE . 0.8 OUTLIER -117.72 163.41 16.52 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.383 -179.528 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.517 HG23 ' CG ' ' A' ' 33' ' ' GLN . 2.0 m -145.13 134.81 23.42 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.926 179.78 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.57 ' N ' ' CH2' ' A' ' 34' ' ' TRP . 14.0 t -82.58 135.13 35.15 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.928 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -110.62 -32.35 6.92 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.881 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 92.03 -166.95 30.16 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.519 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 42.0 -114.73 0.73 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.751 -0.737 . . . . 0.0 112.631 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -126.07 1.63 7.22 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.659 0.266 . . . . 0.0 111.208 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.503 ' HA ' ' NE ' ' A' ' 52' ' ' ARG . 0.1 OUTLIER -59.25 -38.39 79.95 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.785 0.326 . . . . 0.0 110.98 -179.923 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 70.59 141.34 0.19 Allowed Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.631 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.574 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 7.7 p90 -59.7 172.97 0.62 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.848 0.356 . . . . 0.0 110.807 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -156.06 108.35 2.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.762 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.51 ' HB3' ' CD2' ' A' ' 43' ' ' LEU . 2.1 m -75.5 172.18 12.98 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.032 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -141.28 -94.06 0.14 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.125 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.454 ' HA ' HD13 ' A' ' 43' ' ' LEU . 1.9 t 178.86 131.33 0.08 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.874 0.369 . . . . 0.0 110.917 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.792 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 . . . . . 0 N--CA 1.455 -0.18 0 CA-C-O 120.777 0.322 . . . . 0.0 110.57 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 72.77 -172.65 0.14 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.947 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.453 ' HA ' ' O ' ' A' ' 75' ' ' TYR . 24.4 p 48.83 -167.03 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.02 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.467 ' O ' ' HA ' ' A' ' 74' ' ' THR . 5.7 p 167.23 177.8 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.962 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 38.3 t80 -129.36 111.53 12.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.906 179.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -79.38 94.13 5.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.926 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.428 ' HB3' ' CD1' ' A' ' 70' ' ' TYR . 0.1 OUTLIER -51.87 173.91 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.749 179.925 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . 0.481 ' N ' ' CD1' ' A' ' 70' ' ' TYR . 0.8 OUTLIER 76.19 -54.58 0.6 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.815 -179.961 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -107.22 -17.57 14.12 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.108 179.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 54.07 72.72 0.5 Allowed Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.48 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -140.83 96.27 2.99 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.789 0.328 . . . . 0.0 110.838 -179.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' THR . . . . . 0.467 ' HA ' ' O ' ' A' ' 66' ' ' CYS . 85.0 m -50.74 135.99 22.69 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.033 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.453 ' O ' ' HA ' ' A' ' 65' ' ' THR . 21.9 m-85 -129.47 175.3 8.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.893 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.09 133.84 41.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.826 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.408 ' HA ' ' O ' ' A' ' 94' ' ' CYS . 7.1 p -46.4 -39.77 3.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.029 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -94.99 33.14 5.57 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.472 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -135.13 114.67 12.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.882 0.373 . . . . 0.0 110.955 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.449 HG21 HG21 ' A' ' 93' ' ' THR . 44.9 p -86.36 150.31 24.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.163 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . 0.5 ' CE1' ' HB3' ' A' ' 92' ' ' CYS . 32.9 p90 -139.4 -178.6 5.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.808 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.412 ' OE2' ' OD1' ' A' ' 108' ' ' ASN . 1.9 mp0 -115.97 151.38 35.54 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.888 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 14.7 ttm180 -139.31 101.03 7.59 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.96 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -75.34 113.71 3.83 Favored 'Trans proline' 0 N--CA 1.464 -0.264 0 C-N-CA 122.798 2.332 . . . . 0.0 112.364 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.7 mtpp -157.34 161.95 39.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.924 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 50.06 25.5 1.73 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.871 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.2 t 72.98 8.11 5.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.041 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' MET . . . . . 0.447 ' O ' ' NE1' ' A' ' 90' ' ' TRP . 0.0 OUTLIER -138.57 134.02 33.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.955 179.991 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.54 ' C ' ' CD1' ' A' ' 90' ' ' TRP . 2.8 mp -85.3 157.97 3.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.058 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' TRP . . . . . 0.564 ' CZ3' HD11 ' A' ' 106' ' ' ILE . 4.5 m95 -148.89 107.95 3.89 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.95 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.507 ' N ' ' O ' ' A' ' 105' ' ' THR . 11.1 t70 -58.58 91.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.785 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . 0.5 ' HB3' ' CE1' ' A' ' 81' ' ' TYR . 0.8 OUTLIER -74.46 150.49 39.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.134 -179.939 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' THR . . . . . 0.52 ' O ' ' N ' ' A' ' 95' ' ' ILE . 41.7 m -127.49 108.1 10.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.993 179.875 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . 0.408 ' O ' ' HA ' ' A' ' 77' ' ' VAL . 20.3 t -53.85 82.35 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.948 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.52 ' N ' ' O ' ' A' ' 93' ' ' THR . 1.5 mt -77.89 -26.57 14.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.216 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.449 ' HA3' ' HA3' ' A' ' 100' ' ' GLY . . . -158.42 164.03 33.26 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.514 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.457 ' O ' ' N ' ' A' ' 99' ' ' ARG . . . -91.92 104.14 16.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.781 0.324 . . . . 0.0 111.098 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 36.95 30.7 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.479 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.457 ' N ' ' O ' ' A' ' 97' ' ' ALA . 0.4 OUTLIER -147.98 -46.14 0.16 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.783 0.325 . . . . 0.0 110.935 -179.962 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . 0.48 ' C ' ' CG ' ' A' ' 101' ' ' ARG . . . -65.08 -98.07 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.572 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.48 ' CG ' ' C ' ' A' ' 100' ' ' GLY . 0.0 OUTLIER 172.02 94.3 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.751 0.31 . . . . 0.0 110.95 -179.987 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . 0.415 HD12 HG22 ' A' ' 102' ' ' ILE . 43.0 mt -72.07 78.15 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.125 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' SER . . . . . 0.454 ' O ' ' HA ' ' A' ' 92' ' ' CYS . 1.4 t -54.93 151.06 9.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.078 -179.915 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . 0.459 ' SG ' ' HB2' ' A' ' 90' ' ' TRP . 0.0 OUTLIER -130.31 150.99 51.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.75 179.924 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' THR . . . . . 0.507 ' O ' ' N ' ' A' ' 91' ' ' ASP . 0.2 OUTLIER -167.28 134.2 2.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.916 0.389 . . . . 0.0 111.356 -179.947 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.564 HD11 ' CZ3' ' A' ' 90' ' ' TRP . 1.2 mp -66.57 165.25 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.118 179.863 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . 68.61 120.08 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.142 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . 0.412 ' OD1' ' OE2' ' A' ' 82' ' ' GLU . 0.1 OUTLIER -88.73 76.45 8.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.943 -179.979 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . 0.406 ' OXT' ' HG2' ' A' ' 109' ' ' ARG . 20.0 ttt85 . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.293 -0.861 . . . . 0.0 110.879 179.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_exo . . . . . 0 N--CA 1.465 -0.191 0 CA-C-O 120.881 0.284 . . . . 0.0 112.419 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 137.02 163.29 9.68 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.464 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.3 m -112.14 135.19 53.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.826 0.346 . . . . 0.0 110.914 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -115.09 115.68 27.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.85 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -160.21 159.92 32.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.853 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.512 ' O ' ' ND2' ' A' ' 24' ' ' ASN . 12.4 t30 58.8 25.19 13.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.9 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 72.89 7.27 69.83 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.443 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.48 ' HB3' ' CZ ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -122.91 142.3 50.95 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.756 0.312 . . . . 0.0 111.004 179.963 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 2.9 t-160 -114.49 88.28 2.82 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.862 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.48 ' CZ ' ' HB3' ' A' ' 26' ' ' LYS . 0.5 OUTLIER -79.63 -170.28 2.3 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.939 -179.939 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.47 ' O ' ' HB2' ' A' ' 32' ' ' GLN . 0.0 OUTLIER -102.12 173.24 6.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.953 -179.962 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.442 ' HA ' ' SG ' ' A' ' 47' ' ' CYS . 2.9 mp -66.4 155.63 7.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.469 -179.777 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 85.7 m-20 53.78 18.02 1.44 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.202 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.47 ' HB2' ' O ' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -95.29 151.46 19.23 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.668 179.823 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 -115.8 144.77 43.53 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.101 -179.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . 0.526 ' CZ3' ' HB2' ' A' ' 47' ' ' CYS . 41.2 p90 -148.9 178.78 8.38 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.753 179.663 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -103.11 129.87 50.1 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.025 0.441 . . . . 0.0 111.28 -179.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.528 ' O ' ' N ' ' A' ' 43' ' ' LEU . 32.5 ttt-85 -132.99 170.66 15.04 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.296 179.558 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.454 ' HA ' ' HB2' ' A' ' 43' ' ' LEU . 1.2 t -139.46 132.78 29.99 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.872 0.368 . . . . 0.0 111.477 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.452 ' CB ' HD22 ' A' ' 43' ' ' LEU . 45.9 t80 -124.05 124.21 42.04 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.655 179.793 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 70.33 22.37 5.39 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.989 0.424 . . . . 0.0 110.478 -179.711 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 76.4 41.06 26.53 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.923 -0.656 . . . . 0.0 112.501 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 -145.46 138.08 25.92 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.819 0.342 . . . . 0.0 111.254 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.469 ' O ' HD12 ' A' ' 43' ' ' LEU . . . -37.75 152.31 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.876 179.827 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.528 ' N ' ' O ' ' A' ' 36' ' ' ARG . 2.2 tp -167.28 159.62 12.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.22 -179.839 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.488 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.6 t -130.24 129.11 64.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.661 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.567 ' SG ' ' CD1' ' A' ' 54' ' ' PHE . 0.8 OUTLIER -110.75 163.53 13.68 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.32 -179.715 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 35.4 m -144.78 118.41 9.17 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.031 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.526 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 35.2 t -72.71 145.62 47.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.018 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.491 ' CB ' ' HB3' ' A' ' 52' ' ' ARG . 4.9 m-85 -119.39 -16.3 8.98 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.921 179.939 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.417 ' O ' ' C ' ' A' ' 50' ' ' GLY . . . 92.57 179.95 40.5 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.505 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . 0.417 ' C ' ' O ' ' A' ' 49' ' ' GLY . . . 36.13 -107.8 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.482 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 28.4 t -131.67 7.79 4.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.776 0.322 . . . . 0.0 111.05 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.491 ' HB3' ' CB ' ' A' ' 48' ' ' TYR . 7.3 mmt180 -52.66 -19.77 2.61 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.966 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 68.62 151.59 0.38 Allowed Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.355 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.567 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 4.3 p90 -92.96 157.95 16.06 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.834 0.35 . . . . 0.0 110.945 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -116.87 115.6 25.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.623 179.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.488 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.1 OUTLIER -102.93 152.81 20.87 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.203 -179.778 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -175.26 179.49 1.51 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.814 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 26.7 t -73.9 135.14 43.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.925 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 3.9 tptp . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.931 -179.999 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.459 ' OE2' ' HB2' ' A' ' 97' ' ' ALA . 1.4 tt0 . . . . . 0 N--CA 1.456 -0.17 0 CA-C-O 120.928 0.394 . . . . 0.0 110.468 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.01 -176.38 2.07 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.91 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.5 p 64.85 -162.27 0.27 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.198 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.463 ' O ' ' HA ' ' A' ' 74' ' ' THR . 29.0 m -160.19 157.6 28.58 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.857 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.429 ' O ' ' C ' ' A' ' 68' ' ' ASP . 71.2 t80 -110.14 -17.65 13.5 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.67 179.776 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . 0.443 ' OD2' ' CE2' ' A' ' 81' ' ' TYR . 4.3 t0 35.52 93.56 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.027 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.577 ' O ' ' CD2' ' A' ' 70' ' ' TYR . 4.0 ptmt -52.87 -170.13 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.624 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . 0.577 ' CD2' ' O ' ' A' ' 69' ' ' LYS . 8.1 m-85 83.87 -56.4 0.14 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.837 0.351 . . . . 0.0 110.922 -179.829 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -134.45 17.55 3.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.159 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 45.14 58.68 4.92 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.391 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -89.61 164.86 14.57 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.811 0.339 . . . . 0.0 110.894 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' THR . . . . . 0.463 ' HA ' ' O ' ' A' ' 66' ' ' CYS . 0.9 OUTLIER -118.29 90.19 3.28 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.134 179.905 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 16.6 m-30 -97.94 -168.85 1.73 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.861 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.94 162.49 30.54 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.763 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 3.4 t -76.58 -22.92 15.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.134 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -92.18 15.04 63.01 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.566 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -151.53 113.73 4.54 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.771 0.319 . . . . 0.0 110.815 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.52 ' HB ' ' CG2' ' A' ' 93' ' ' THR . 1.3 t -74.18 179.43 4.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.12 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . 0.509 ' N ' ' OG1' ' A' ' 80' ' ' THR . 45.7 p90 -153.71 168.26 26.84 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.931 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -110.64 144.21 39.89 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.706 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.04 96.02 4.35 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.0 -179.888 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_exo -56.22 138.88 84.8 Favored 'Trans proline' 0 N--CA 1.466 -0.134 0 C-N-CA 122.836 2.357 . . . . 0.0 112.044 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.428 ' O ' ' N ' ' A' ' 87' ' ' SER . 0.2 OUTLIER -155.39 165.11 37.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.917 0.389 . . . . 0.0 111.095 -179.932 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 46.76 -92.7 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.024 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' SER . . . . . 0.428 ' N ' ' O ' ' A' ' 85' ' ' LYS . 0.8 OUTLIER -152.16 18.37 0.66 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.969 -179.964 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' MET . . . . . 0.4 ' CE ' ' HA ' ' A' ' 88' ' ' MET . 0.6 OUTLIER -147.1 167.45 24.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.878 -179.995 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.411 ' O ' ' N ' ' A' ' 107' ' ' ALA . 4.0 mt -107.39 140.34 26.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.063 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' TRP . . . . . 0.533 ' N ' ' CD1' ' A' ' 90' ' ' TRP . 0.7 OUTLIER -131.86 124.5 29.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.953 -179.868 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -67.1 72.08 0.1 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.742 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . 0.469 ' HA ' ' O ' ' A' ' 103' ' ' SER . 54.3 m -59.89 111.83 1.62 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.024 -179.845 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' THR . . . . . 0.52 ' CG2' ' HB ' ' A' ' 80' ' ' THR . 32.2 m -103.79 119.74 39.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.98 179.803 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . 0.45 ' SG ' HD11 ' A' ' 102' ' ' ILE . 0.0 OUTLIER -58.53 80.53 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.832 -179.907 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.467 ' N ' ' O ' ' A' ' 93' ' ' THR . 2.1 mt -98.87 101.05 11.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.312 -179.84 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 144.66 176.19 18.45 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.5 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.459 ' HB2' ' OE2' ' A' ' 63' ' ' GLU . . . -69.23 58.82 0.11 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.837 0.351 . . . . 0.0 111.087 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.43 -23.47 15.53 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.559 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -176.58 55.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.846 0.355 . . . . 0.0 110.961 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -89.75 -37.16 6.99 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.39 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.517 ' O ' ' N ' ' A' ' 103' ' ' SER . 2.3 ptp85 -178.58 49.33 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.842 0.353 . . . . 0.0 110.74 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . 0.45 HD11 ' SG ' ' A' ' 94' ' ' CYS . 10.4 mm -38.39 90.48 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.262 -179.903 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' SER . . . . . 0.517 ' N ' ' O ' ' A' ' 101' ' ' ARG . 21.9 t -69.08 174.2 4.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.603 179.777 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . 0.443 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 20.1 m -155.76 124.35 5.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.032 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 2.9 p -92.89 104.67 16.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.108 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.515 HG13 ' CZ3' ' A' ' 90' ' ' TRP . 1.3 tt -43.99 151.0 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.083 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . 0.411 ' N ' ' O ' ' A' ' 89' ' ' ILE . . . -121.91 126.25 48.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.063 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 22.1 p30 -147.49 173.14 12.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.888 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.284 -0.865 . . . . 0.0 110.866 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_exo . . . . . 0 N--CA 1.465 -0.158 0 CA-C-O 120.804 0.252 . . . . 0.0 112.303 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.18 -167.82 45.91 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.454 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 54.5 m -126.79 132.42 51.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.842 0.353 . . . . 0.0 110.938 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 11.9 t80 -105.98 123.17 47.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.772 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -156.99 134.25 10.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.057 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.465 ' OD1' ' O ' ' A' ' 24' ' ' ASN . 29.8 t30 63.33 11.09 5.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.132 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 97.49 -13.19 64.5 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.8 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.77 146.44 24.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.784 0.326 . . . . 0.0 110.708 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 9.9 t-160 -118.21 90.89 3.43 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.264 -179.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -80.91 -165.82 0.99 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.822 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.52 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 0.5 OUTLIER -116.59 158.71 23.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.729 179.799 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.498 HG22 ' ND2' ' A' ' 31' ' ' ASN . 3.2 mp -51.98 152.54 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.303 -179.791 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.498 ' ND2' HG22 ' A' ' 30' ' ' ILE . 1.6 m-80 55.07 20.49 3.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.162 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.52 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 18.7 tt0 -101.28 152.08 21.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.759 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.416 ' HG2' ' OG1' ' A' ' 46' ' ' THR . 19.9 mt-30 -117.22 145.11 44.11 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.021 -179.836 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . 0.578 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 38.2 p90 -146.89 177.56 9.03 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.736 179.771 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -107.78 133.33 52.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.285 -179.631 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.436 ' NE ' ' O ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -132.78 -168.83 2.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.449 179.569 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.46 ' HA ' ' HB2' ' A' ' 43' ' ' LEU . 1.1 t -158.48 145.4 17.57 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.886 0.374 . . . . 0.0 111.283 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -132.77 132.28 42.08 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.655 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 57.4 22.36 7.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.563 -179.727 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 81.88 42.69 8.74 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.859 -0.686 . . . . 0.0 112.558 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.443 ' O ' ' OG1' ' A' ' 37' ' ' THR . 83.9 m-20 -143.6 130.95 20.92 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 120.802 0.334 . . . . 0.0 111.137 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.522 ' O ' ' CD1' ' A' ' 43' ' ' LEU . . . -39.34 156.64 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.838 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.522 ' CD1' ' O ' ' A' ' 42' ' ' ALA . 1.4 tp -169.32 160.07 9.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.217 -179.905 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.485 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.9 t -127.29 128.77 70.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.625 179.624 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.578 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 0.8 OUTLIER -114.69 151.39 33.71 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.148 -179.719 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.416 ' OG1' ' HG2' ' A' ' 33' ' ' GLN . 29.3 m -135.61 133.75 38.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.054 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.5 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 28.4 t -85.7 160.86 19.44 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.813 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.495 ' CD1' ' O ' ' A' ' 53' ' ' GLY . 75.1 m-85 -133.36 -39.65 0.91 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.943 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.475 ' O ' ' N ' ' A' ' 51' ' ' SER . . . 154.74 45.52 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.5 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 64.52 -69.32 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.44 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' SER . . . . . 0.475 ' N ' ' O ' ' A' ' 49' ' ' GLY . 12.2 m -63.86 -48.06 78.25 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.805 0.336 . . . . 0.0 110.847 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.494 ' HB3' ' CB ' ' A' ' 48' ' ' TYR . 0.2 OUTLIER -56.63 -23.36 40.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.865 179.9 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . 0.495 ' O ' ' CD1' ' A' ' 48' ' ' TYR . . . 68.98 145.43 0.16 Allowed Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.594 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.569 ' CE1' ' SG ' ' A' ' 45' ' ' CYS . 13.1 p90 -86.73 170.05 12.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.872 0.368 . . . . 0.0 110.798 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.42 ' O ' ' HA ' ' A' ' 45' ' ' CYS . 5.0 m120 -141.0 138.28 33.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.728 179.857 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.485 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.5 OUTLIER -117.83 159.97 22.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.105 -179.846 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . 0.443 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.6 pm0 -168.42 172.14 8.55 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.865 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.459 ' HA ' HD12 ' A' ' 43' ' ' LEU . 0.9 OUTLIER -76.5 152.27 36.14 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.872 -179.999 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.953 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.455 -0.221 0 CA-C-O 120.805 0.336 . . . . 0.0 110.483 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.465 ' HB3' HG12 ' A' ' 77' ' ' VAL . 1.6 mp0 -81.24 156.68 25.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.789 179.831 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.459 ' OG1' ' N ' ' A' ' 66' ' ' CYS . 2.6 t 175.37 177.97 0.17 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.996 0.427 . . . . 0.0 111.378 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.459 ' N ' ' OG1' ' A' ' 65' ' ' THR . 0.1 OUTLIER 175.11 -162.34 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.727 -179.989 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.466 ' HA ' ' O ' ' A' ' 73' ' ' ASN . 68.9 t80 -170.07 -38.73 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.045 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 4.6 t70 49.98 88.11 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.757 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.453 ' C ' ' CG ' ' A' ' 70' ' ' TYR . 1.8 mtmt -59.31 159.5 7.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.89 -179.876 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . 0.453 ' CG ' ' C ' ' A' ' 69' ' ' LYS . 1.0 OUTLIER 77.68 17.35 1.4 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.008 179.981 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 2.9 m -162.86 -44.93 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.234 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 77.0 75.33 0.92 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.581 -0.818 . . . . 0.0 112.49 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . 0.466 ' O ' ' HA ' ' A' ' 67' ' ' PHE . 3.0 m120 -129.42 -172.29 2.71 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.88 0.371 . . . . 0.0 110.808 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 1.3 m -146.8 100.85 3.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.022 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.41 ' N ' ' CD1' ' A' ' 75' ' ' TYR . 3.6 m-30 -92.85 -160.54 0.76 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.81 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . 0.456 ' O ' ' C ' ' A' ' 77' ' ' VAL . 0.4 OUTLIER -142.85 60.51 1.42 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.785 179.825 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.514 ' CG2' ' O ' ' A' ' 77' ' ' VAL . 6.6 p 29.32 44.71 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.62 179.807 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -160.41 41.55 0.44 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.508 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -160.75 109.06 1.6 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.775 0.321 . . . . 0.0 110.861 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 1.1 t -96.15 172.44 7.98 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.113 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 42.2 p90 -165.54 -174.04 2.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.829 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 -114.77 126.07 54.42 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.832 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 5.0 ttm180 -130.77 90.99 38.45 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.129 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -57.33 120.46 8.39 Favored 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.744 2.296 . . . . 0.0 112.061 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.6 tptp -126.08 146.26 50.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.013 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 60.74 -84.66 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.934 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.1 p -155.81 21.47 0.39 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.017 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 1.8 ttt -144.55 164.71 30.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.881 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.495 ' C ' ' CD1' ' A' ' 90' ' ' TRP . 2.2 mt -99.42 150.99 4.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.139 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' TRP . . . . . 0.57 ' CE3' ' HA ' ' A' ' 106' ' ' ILE . 4.5 m95 -147.08 120.72 9.15 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.867 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.441 ' OD1' ' N ' ' A' ' 91' ' ' ASP . 0.1 OUTLIER -70.82 58.49 0.21 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.985 -179.959 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . 0.406 ' HA ' ' HA ' ' A' ' 104' ' ' CYS . 84.5 m -45.4 136.24 5.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.871 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' THR . . . . . 0.43 HG22 ' N ' ' A' ' 94' ' ' CYS . 40.9 m -122.72 139.25 54.17 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.146 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . 0.43 ' N ' HG22 ' A' ' 93' ' ' THR . 30.8 t -69.95 68.2 0.29 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.848 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.458 HD12 HG21 ' A' ' 95' ' ' ILE . 2.6 mt -77.88 123.21 34.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.276 -179.846 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.514 ' O ' ' CB ' ' A' ' 97' ' ' ALA . . . -145.28 -151.52 5.43 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.515 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.514 ' CB ' ' O ' ' A' ' 96' ' ' GLY . . . 85.17 72.49 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.807 0.337 . . . . 0.0 111.136 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 92.04 -59.27 2.77 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.515 -179.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.454 ' O ' ' HD2' ' A' ' 101' ' ' ARG . 0.0 OUTLIER -163.82 56.96 0.17 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.865 0.364 . . . . 0.0 110.97 -179.966 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . 0.458 ' O ' ' O ' ' A' ' 101' ' ' ARG . . . -80.88 -40.1 12.48 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.435 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.458 ' O ' ' O ' ' A' ' 100' ' ' GLY . 0.0 OUTLIER 55.15 115.89 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.833 0.349 . . . . 0.0 110.863 -179.941 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . 0.451 HD13 ' SG ' ' A' ' 66' ' ' CYS . 2.2 mm -44.98 94.36 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.121 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' SER . . . . . 0.419 ' N ' ' O ' ' A' ' 101' ' ' ARG . 15.5 t -76.65 149.37 36.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.909 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . 0.406 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 92.5 m -132.75 102.69 5.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.961 -179.946 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 14.8 t -84.81 143.0 29.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.061 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.57 ' HA ' ' CE3' ' A' ' 90' ' ' TRP . 7.3 tt -70.94 140.36 18.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.053 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -103.97 145.54 29.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.115 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -125.18 14.26 8.37 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.955 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 3.1 ttp180 . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.263 -0.875 . . . . 0.0 110.899 -179.95 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo . . . . . 0 C--O 1.232 0.193 0 CA-C-O 120.874 0.281 . . . . 0.0 112.391 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . 0.457 ' HA2' HG13 ' A' ' 30' ' ' ILE . . . 67.68 -143.64 42.41 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.526 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -159.68 52.41 0.35 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.861 0.362 . . . . 0.0 110.954 -179.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.586 ' N ' ' CD2' ' A' ' 27' ' ' HIS . 0.4 OUTLIER -47.88 102.78 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.886 -179.987 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -77.95 -167.24 0.95 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.846 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -43.07 -54.86 4.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.886 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -140.98 8.25 2.71 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.472 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.518 ' HB3' ' CE1' ' A' ' 28' ' ' TYR . 0.1 OUTLIER -127.94 131.47 49.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.79 0.328 . . . . 0.0 110.816 179.988 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . 0.586 ' CD2' ' N ' ' A' ' 22' ' ' TYR . 9.2 t-160 -117.52 88.67 2.96 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.034 -179.766 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.518 ' CE1' ' HB3' ' A' ' 26' ' ' LYS . 6.9 m-85 -79.68 161.71 25.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.888 179.864 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.532 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 4.0 mt-30 -84.73 137.4 33.24 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.618 179.721 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.525 HG21 ' CA ' ' A' ' 49' ' ' GLY . 3.9 mp -37.83 147.28 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 120.904 0.383 . . . . 0.0 111.189 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.462 ' HB2' ' O ' ' A' ' 30' ' ' ILE . 26.5 m-80 67.29 11.89 8.63 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.157 179.76 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.532 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 41.7 tt0 -100.33 144.55 29.2 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.785 0.326 . . . . 0.0 110.771 179.726 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 13.2 mt-30 -111.74 156.63 21.6 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.003 0.43 . . . . 0.0 111.278 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . 0.484 ' CZ3' ' HB2' ' A' ' 47' ' ' CYS . 48.3 p90 -163.06 162.67 25.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.641 179.836 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -106.5 124.86 50.23 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.938 0.399 . . . . 0.0 111.1 -179.725 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.485 ' N ' ' O ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -123.52 -169.95 2.03 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.595 179.642 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.3 t -150.26 131.49 14.53 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.161 179.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.474 ' CB ' HD23 ' A' ' 43' ' ' LEU . 20.2 t80 -121.77 139.85 53.08 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.506 179.752 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 55.88 20.03 3.91 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.943 0.401 . . . . 0.0 110.387 -179.701 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 78.52 46.21 9.02 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.944 -0.646 . . . . 0.0 112.617 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.425 ' O ' ' C ' ' A' ' 42' ' ' ALA . 35.6 m-80 -151.32 132.21 14.19 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.808 0.337 . . . . 0.0 110.969 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.425 ' C ' ' O ' ' A' ' 41' ' ' ASN . . . -36.04 147.59 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.982 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.485 ' O ' ' N ' ' A' ' 36' ' ' ARG . 1.8 tp -159.53 147.28 17.2 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.07 -179.842 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.493 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 3.2 t -122.21 131.56 72.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.6 179.7 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.57 ' SG ' ' CD1' ' A' ' 54' ' ' PHE . 0.8 OUTLIER -117.47 152.42 35.07 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.268 -179.678 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.455 ' O ' ' CE1' ' A' ' 48' ' ' TYR . 88.4 m -138.78 112.76 8.53 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.02 179.83 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.484 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 8.7 t -77.05 134.58 38.74 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.947 179.898 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.466 ' O ' ' CG2' ' A' ' 30' ' ' ILE . 2.0 m-85 -106.84 -45.34 4.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.926 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.525 ' CA ' HG21 ' A' ' 30' ' ' ILE . . . 117.89 -172.52 14.42 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.508 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 41.42 -112.11 0.35 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.571 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -110.64 -21.15 12.26 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.799 0.333 . . . . 0.0 111.017 -179.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 3.8 mtt180 -47.6 -29.84 3.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.824 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 64.6 -124.67 29.63 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.599 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.57 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 8.1 p90 -155.98 155.04 32.06 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.83 0.348 . . . . 0.0 110.864 -179.817 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -124.43 132.63 53.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.719 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.493 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.1 OUTLIER -112.42 160.96 17.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.114 -179.915 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 178.36 171.93 0.72 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.917 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 79.1 p -59.44 116.16 3.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.931 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.409 ' HD3' ' C ' ' A' ' 59' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.973 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 . . . . . 0 N--CA 1.446 -0.637 0 CA-C-O 120.861 0.363 . . . . 0.0 111.146 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -106.06 79.23 1.38 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.806 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.495 ' OG1' ' N ' ' A' ' 66' ' ' CYS . 0.1 OUTLIER -168.9 174.41 6.46 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.185 -179.948 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.495 ' N ' ' OG1' ' A' ' 65' ' ' THR . 1.6 p 173.93 105.06 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.856 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 85.3 t80 -62.36 117.46 6.16 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.91 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . 0.473 ' O ' ' N ' ' A' ' 70' ' ' TYR . 6.1 t0 -89.14 78.87 7.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.865 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.417 ' C ' ' O ' ' A' ' 68' ' ' ASP . 9.4 pttp -36.08 -31.55 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.849 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . 0.473 ' N ' ' O ' ' A' ' 68' ' ' ASP . 5.2 m-85 -40.79 -56.16 2.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.965 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.421 HG21 ' ND2' ' A' ' 73' ' ' ASN . 12.8 t -126.8 -36.21 2.23 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.166 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 125.11 10.6 4.62 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.53 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . 0.464 ' O ' ' HB2' ' A' ' 68' ' ' ASP . 66.5 m-20 -97.06 140.25 31.85 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.827 0.346 . . . . 0.0 110.848 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 4.1 t -103.92 140.96 36.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.084 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -126.42 -178.62 4.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.797 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -78.48 124.73 28.46 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.87 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.413 ' HA ' ' O ' ' A' ' 94' ' ' CYS . 8.9 p -46.43 -42.68 5.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.175 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -86.85 38.34 3.13 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.496 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -123.34 139.52 53.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.814 0.34 . . . . 0.0 110.894 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 24.1 p -111.99 109.32 19.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.093 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . 0.415 ' C ' ' OD1' ' A' ' 91' ' ' ASP . 6.4 p90 -121.04 143.34 49.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.834 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -85.15 175.08 9.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.928 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.419 ' HA ' ' HD2' ' A' ' 84' ' ' PRO . 0.0 OUTLIER -164.98 111.12 0.83 Allowed Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.792 179.952 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.419 ' HD2' ' HA ' ' A' ' 83' ' ' ARG . 25.0 Cg_endo -62.2 137.38 65.78 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.718 2.278 . . . . 0.0 112.277 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -171.77 132.41 0.72 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.901 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 54.71 -160.36 0.16 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.911 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.2 p -89.64 33.71 0.84 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.87 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' MET . . . . . 0.506 ' O ' ' NE1' ' A' ' 90' ' ' TRP . 2.6 ttm -162.71 129.54 3.57 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.823 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 1.3 mt -91.67 133.6 32.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.205 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' TRP . . . . . 0.595 ' N ' ' CD1' ' A' ' 90' ' ' TRP . 0.0 OUTLIER -127.5 123.44 35.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.912 179.891 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.415 ' OD1' ' C ' ' A' ' 81' ' ' TYR . 41.8 t0 -76.61 102.02 5.96 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.931 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . 0.488 ' HA ' ' HA ' ' A' ' 104' ' ' CYS . 1.1 m -81.21 117.48 21.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.01 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 30.3 m -88.33 127.64 35.48 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.018 179.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . 0.413 ' O ' ' HA ' ' A' ' 77' ' ' VAL . 0.1 OUTLIER -68.22 86.2 0.27 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.914 -179.919 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 1.2 mt -99.33 61.58 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.352 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -96.71 -114.27 3.07 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.549 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . 68.08 20.75 8.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.95 0.405 . . . . 0.0 111.112 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 156.02 -52.58 0.43 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.722 -0.752 . . . . 0.0 112.327 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.438 ' CG ' ' O ' ' A' ' 99' ' ' ARG . 0.0 OUTLIER -133.12 94.12 3.3 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.826 0.346 . . . . 0.0 110.873 179.993 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -36.72 98.35 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.835 -0.698 . . . . 0.0 112.552 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -117.66 48.95 1.28 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.756 0.313 . . . . 0.0 110.813 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 2.2 mp -56.22 102.55 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.192 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 32.5 t -98.6 129.42 45.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.738 179.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . 0.488 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 0.7 OUTLIER -99.53 148.41 24.3 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.97 0.414 . . . . 0.0 111.033 -179.888 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -157.05 112.48 2.85 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.061 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.588 ' CD1' ' CZ3' ' A' ' 90' ' ' TRP . 3.3 mp -40.3 131.95 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.173 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -96.27 108.56 21.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.083 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 3.8 p30 -132.08 36.21 3.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.906 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 9.2 mtp85 . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.945 -179.955 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo . . . . . 0 C--O 1.231 0.163 0 CA-C-O 120.806 0.252 . . . . 0.0 112.275 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 95.4 177.76 37.18 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.384 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 69.6 m -112.58 126.58 55.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.81 0.338 . . . . 0.0 110.877 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 15.0 t80 -119.39 121.47 39.6 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.975 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.423 ' O ' ' C ' ' A' ' 24' ' ' ASN . 2.0 t0 -99.33 -162.5 0.96 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.942 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.423 ' C ' ' O ' ' A' ' 23' ' ' ASP . 7.9 t-20 -35.81 -53.14 0.73 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.954 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -153.64 20.76 0.7 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.588 -179.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.411 ' HB3' ' CE2' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -121.41 132.66 54.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.889 0.376 . . . . 0.0 110.952 179.868 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 13.5 t-160 -115.0 91.56 3.65 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.096 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.454 ' HB3' ' OE1' ' A' ' 32' ' ' GLN . 0.1 OUTLIER -83.15 -178.39 7.09 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.929 179.915 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.524 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 1.7 tt0 -114.21 152.41 31.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.548 179.636 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.451 ' HA ' ' SG ' ' A' ' 47' ' ' CYS . 3.4 mp -49.47 154.03 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.153 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 10.7 m-20 59.53 17.95 6.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.02 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.524 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 2.2 tt0 -105.25 142.54 34.84 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.81 179.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -115.93 140.71 48.97 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.05 -179.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . 0.584 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 39.6 p90 -148.5 -173.34 4.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.807 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 61.6 tt0 -120.01 121.67 39.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.925 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.447 ' O ' HD21 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -106.81 156.45 18.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.821 179.982 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.3 m -110.09 139.43 45.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.678 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.484 ' CB ' HD22 ' A' ' 43' ' ' LEU . 1.0 OUTLIER -155.2 110.65 3.07 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.783 179.827 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 66.56 38.2 4.22 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.613 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 65.31 44.85 92.91 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.446 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 19.4 m120 -135.78 175.09 9.91 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 120.811 0.338 . . . . 0.0 110.933 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.413 ' C ' ' CD1' ' A' ' 43' ' ' LEU . . . -117.1 104.15 10.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.905 179.834 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.583 ' N ' ' CD1' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -114.73 118.92 34.98 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.25 -179.786 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.471 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.7 t -71.13 128.48 34.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.369 179.368 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.584 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 1.9 m -106.17 157.82 17.28 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.148 -179.598 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.443 ' O ' ' CE1' ' A' ' 48' ' ' TYR . 8.6 m -146.63 121.51 9.97 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.083 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.455 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 18.3 t -79.95 134.29 36.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.97 -179.826 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.454 ' HB2' ' HB3' ' A' ' 52' ' ' ARG . 1.4 m-85 -104.95 -45.94 4.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.983 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 114.13 -173.86 15.19 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.423 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 39.81 -129.92 2.54 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.535 179.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 18.0 m -102.27 26.13 8.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.767 0.318 . . . . 0.0 110.964 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.454 ' HB3' ' HB2' ' A' ' 48' ' ' TYR . 9.0 mmt180 -87.57 -47.24 8.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.173 -179.846 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 65.3 160.77 0.62 Allowed Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.507 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.573 ' CE1' ' SG ' ' A' ' 45' ' ' CYS . 0.6 OUTLIER -73.99 149.95 41.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.822 0.344 . . . . 0.0 110.835 -179.993 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -112.38 -45.86 3.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.966 -179.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.471 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.1 OUTLIER 72.39 146.16 0.08 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.889 -179.966 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . 0.408 ' CG ' ' N ' ' A' ' 58' ' ' SER . 0.9 OUTLIER -124.48 -89.94 0.57 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.933 179.958 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.481 ' HA ' ' HA ' ' A' ' 43' ' ' LEU . 67.4 m -165.45 177.34 7.54 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.713 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.793 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.407 ' HG3' ' N ' ' A' ' 64' ' ' GLU . 1.1 tt0 . . . . . 0 N--CA 1.455 -0.189 0 CA-C-O 120.797 0.332 . . . . 0.0 110.592 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.407 ' N ' ' HG3' ' A' ' 63' ' ' GLU . 16.8 tt0 -127.13 51.18 1.91 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.964 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -165.91 143.64 5.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.114 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 5.1 m -124.59 -172.17 2.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.766 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.562 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 87.8 t80 -161.78 118.59 2.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.067 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . 0.428 ' O ' ' C ' ' A' ' 69' ' ' LYS . 3.7 t0 -92.22 76.79 5.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.728 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.562 ' HA ' ' CE2' ' A' ' 67' ' ' PHE . 1.3 ptmt -35.18 -35.85 0.05 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.984 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . 0.418 ' N ' ' O ' ' A' ' 68' ' ' ASP . 18.6 m-30 -40.29 -57.24 1.79 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.911 179.875 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 20.5 p -140.48 32.33 1.87 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.105 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 46.36 95.45 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.54 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . 0.464 ' O ' ' HA ' ' A' ' 67' ' ' PHE . 2.0 m-80 -147.18 162.88 37.98 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.792 0.33 . . . . 0.0 110.983 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -132.87 104.59 6.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.154 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.592 ' CD2' ' CE1' ' A' ' 81' ' ' TYR . 0.7 OUTLIER -108.45 13.54 25.38 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.882 -179.926 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . 0.427 ' O ' ' O ' ' A' ' 75' ' ' TYR . 70.9 mtt85 49.15 178.71 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.767 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.444 ' CG2' ' O ' ' A' ' 77' ' ' VAL . 12.2 p -95.53 28.17 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.153 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -146.44 14.15 1.61 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.424 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -134.01 127.53 32.49 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.811 0.338 . . . . 0.0 111.02 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 22.2 p -92.51 164.16 13.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.118 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . 0.592 ' CE1' ' CD2' ' A' ' 75' ' ' TYR . 47.9 p90 -158.55 166.1 32.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.92 -179.927 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -117.18 116.32 27.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.804 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 20.8 mmt-85 -118.23 117.05 35.24 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.946 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -71.96 106.94 2.11 Favored 'Trans proline' 0 C--N 1.342 0.222 0 C-N-CA 122.7 2.267 . . . . 0.0 112.291 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.463 ' O ' ' CB ' ' A' ' 86' ' ' ASP . 1.5 mmpp? -117.61 107.87 14.76 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.876 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.463 ' CB ' ' O ' ' A' ' 85' ' ' LYS . 0.4 OUTLIER 81.85 -153.7 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.801 -179.965 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -81.11 6.95 12.2 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.067 179.904 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 1.4 tpt -137.92 149.22 46.01 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.861 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.53 ' C ' ' CD1' ' A' ' 90' ' ' TRP . 1.4 mt -110.36 154.2 11.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.198 -179.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' TRP . . . . . 0.631 ' N ' ' CD1' ' A' ' 90' ' ' TRP . 0.1 OUTLIER -143.23 150.04 38.77 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.776 179.912 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.447 ' OD1' ' HB3' ' A' ' 108' ' ' ASN . 0.2 OUTLIER -83.28 65.38 8.25 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.957 179.979 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . 0.4 ' HA ' ' HA ' ' A' ' 104' ' ' CYS . 21.4 m -48.12 137.14 10.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.111 179.928 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 18.3 m -145.08 137.52 26.04 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.068 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 5.1 t -74.42 71.82 1.81 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.942 -179.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.488 HD11 HG21 ' A' ' 95' ' ' ILE . 2.3 mt -81.25 66.66 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.296 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.447 ' O ' ' CB ' ' A' ' 97' ' ' ALA . . . 153.1 -83.24 0.16 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.375 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.447 ' CB ' ' O ' ' A' ' 96' ' ' GLY . . . 80.18 80.71 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.803 0.335 . . . . 0.0 111.137 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.54 0.02 86.58 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.589 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 17.9 mtp85 -139.73 -55.53 0.56 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.814 0.34 . . . . 0.0 110.981 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . 0.412 ' CA ' ' CZ ' ' A' ' 101' ' ' ARG . . . -85.61 -103.96 0.7 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.473 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.412 ' CZ ' ' CA ' ' A' ' 100' ' ' GLY . 0.0 OUTLIER 179.73 169.51 1.15 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.766 0.317 . . . . 0.0 110.895 -179.925 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 3.7 mt -97.1 64.77 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.079 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 19.2 t -45.42 155.95 0.13 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.852 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . 0.4 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 81.1 m -150.97 96.36 2.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.945 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' THR . . . . . 0.402 ' O ' ' N ' ' A' ' 91' ' ' ASP . 0.1 OUTLIER -91.37 150.89 21.08 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.129 -179.965 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.534 HD12 ' CZ3' ' A' ' 90' ' ' TRP . 2.3 mp -65.79 144.5 14.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.048 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . 43.64 -163.9 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.086 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . 0.464 ' OD1' ' N ' ' A' ' 108' ' ' ASN . 4.7 p-10 -146.95 157.25 43.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.83 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . 0.435 ' HG2' ' O ' ' A' ' 108' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.959 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo . . . . . 0 N--CA 1.464 -0.263 0 CA-C-O 120.855 0.273 . . . . 0.0 112.312 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . 0.404 ' HA3' ' CE1' ' A' ' 27' ' ' HIS . . . 138.36 -151.72 21.63 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.665 -0.779 . . . . 0.0 112.615 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -158.07 64.83 0.45 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.852 0.358 . . . . 0.0 110.831 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -45.46 137.89 4.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.841 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -162.99 119.82 1.88 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.891 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.404 ' O ' ' CG ' ' A' ' 24' ' ' ASN . 36.6 t30 54.79 30.4 13.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.919 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 85.64 -10.33 65.11 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.539 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.84 128.19 39.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.813 0.34 . . . . 0.0 110.862 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . 0.404 ' CE1' ' HA3' ' A' ' 20' ' ' GLY . 28.6 t-80 -115.28 94.26 4.65 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.193 -179.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -81.71 -168.97 2.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.803 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.531 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 43.1 tt0 -106.01 141.41 37.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.851 179.862 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.524 ' CG2' ' O ' ' A' ' 48' ' ' TYR . 3.6 mp -48.97 146.14 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.252 -179.859 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.453 ' OD1' HG21 ' A' ' 30' ' ' ILE . 0.6 OUTLIER 67.5 12.64 9.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.901 -179.998 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.531 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 52.6 tt0 -98.65 151.63 20.49 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.637 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 18.9 mt-30 -114.57 152.35 31.92 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.096 -179.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . 0.541 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 43.4 p90 -153.05 179.08 9.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.78 179.783 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -109.74 127.73 54.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.866 0.365 . . . . 0.0 111.305 -179.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.521 ' O ' ' N ' ' A' ' 43' ' ' LEU . 39.5 ttt-85 -133.4 171.67 13.74 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.341 179.631 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.431 ' O ' HG21 ' A' ' 37' ' ' THR . 1.5 t -135.29 139.88 44.71 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.782 0.325 . . . . 0.0 111.352 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.442 ' HB2' HD23 ' A' ' 43' ' ' LEU . 3.6 t80 -126.79 126.61 43.7 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.638 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.9 mm? 63.11 25.78 15.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.574 -179.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 76.22 43.07 21.97 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 121.041 -0.599 . . . . 0.0 112.667 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.429 ' O ' ' C ' ' A' ' 42' ' ' ALA . 32.6 m120 -145.56 129.86 17.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.796 0.331 . . . . 0.0 111.074 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.429 ' C ' ' O ' ' A' ' 41' ' ' ASN . . . -37.5 153.98 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.458 179.687 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.521 ' N ' ' O ' ' A' ' 36' ' ' ARG . 4.4 tp -169.52 161.34 9.59 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.082 0.468 . . . . 0.0 111.618 -179.527 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.482 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 19.6 t -124.36 155.88 32.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.232 179.267 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.57 ' SG ' ' CD1' ' A' ' 54' ' ' PHE . 0.5 OUTLIER -139.46 150.46 45.22 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.939 0.4 . . . . 0.0 111.423 -179.618 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 97.9 m -133.89 115.98 15.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.811 179.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.483 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 36.9 t -71.73 156.35 39.44 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.971 -179.844 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.524 ' O ' ' CG2' ' A' ' 30' ' ' ILE . 42.3 m-85 -119.25 -53.28 2.25 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.151 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.472 ' HA2' ' CG2' ' A' ' 30' ' ' ILE . . . 156.82 52.49 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.456 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 48.63 50.21 25.69 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.526 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -149.4 -61.6 0.22 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.832 0.349 . . . . 0.0 110.842 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.517 ' HA ' ' NE ' ' A' ' 52' ' ' ARG . 8.5 mmm180 -68.46 -31.6 71.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.781 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . 0.577 ' O ' ' CD2' ' A' ' 54' ' ' PHE . . . 88.02 24.3 35.33 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 120.881 -0.676 . . . . 0.0 112.533 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.577 ' CD2' ' O ' ' A' ' 53' ' ' GLY . 1.5 p90 56.04 151.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.943 0.402 . . . . 0.0 111.106 179.839 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.401 ' O ' ' OD1' ' A' ' 55' ' ' ASN . 43.6 p-10 -130.44 109.38 10.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.64 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.482 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.7 OUTLIER -83.73 170.06 14.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.103 -179.855 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 172.31 166.76 0.11 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.963 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.451 ' HA ' HD13 ' A' ' 43' ' ' LEU . 5.0 t -58.6 154.68 13.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.951 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.835 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.404 ' OE2' ' HB2' ' A' ' 97' ' ' ALA . 0.8 OUTLIER . . . . . 0 CA--C 1.529 0.154 0 CA-C-O 120.765 0.316 . . . . 0.0 110.503 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.43 ' O ' HG23 ' A' ' 65' ' ' THR . 0.1 OUTLIER 179.5 -166.38 0.07 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.894 -179.968 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.43 HG23 ' O ' ' A' ' 64' ' ' GLU . 30.5 p -158.02 146.03 18.66 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.215 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 25.9 p -121.43 -175.81 3.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.788 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.512 ' CE1' ' HA2' ' A' ' 72' ' ' GLY . 76.6 t80 -137.78 127.79 25.77 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.922 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 33.3 t0 -92.1 92.64 8.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.909 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.473 ' HA ' ' CE2' ' A' ' 67' ' ' PHE . 0.8 OUTLIER -47.79 -25.44 1.27 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.005 -179.967 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . 0.418 ' C ' ' O ' ' A' ' 69' ' ' LYS . 8.2 m-30 -36.27 -59.37 0.63 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.829 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -159.77 30.51 0.19 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.15 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . 0.512 ' HA2' ' CE1' ' A' ' 67' ' ' PHE . . . 71.88 74.48 0.74 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.674 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -138.45 90.83 2.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.723 0.297 . . . . 0.0 110.714 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' THR . . . . . 0.469 HG21 ' N ' ' A' ' 75' ' ' TYR . 34.0 m -69.11 137.32 53.34 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.146 -179.97 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.469 ' N ' HG21 ' A' ' 74' ' ' THR . 66.3 m-85 -126.95 155.55 42.93 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.794 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 11.5 mtp180 -84.22 127.82 34.19 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.917 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 43.0 t -44.72 -27.03 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.108 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -90.08 26.71 9.38 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.589 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -158.39 134.88 9.47 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.826 0.346 . . . . 0.0 111.0 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 5.3 t -111.17 165.28 12.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.905 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . 0.441 ' CE1' ' CD2' ' A' ' 75' ' ' TYR . 19.1 p90 -143.73 173.86 11.31 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.892 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -148.46 110.76 4.65 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.773 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.3 143.56 47.63 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.963 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -68.09 139.0 45.31 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.84 2.36 . . . . 0.0 112.29 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.431 ' O ' ' O ' ' A' ' 88' ' ' MET . 0.1 OUTLIER -160.47 133.58 6.63 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.899 179.943 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.404 ' O ' ' OG ' ' A' ' 87' ' ' SER . 0.9 OUTLIER 56.48 52.16 10.31 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.906 179.989 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' SER . . . . . 0.404 ' OG ' ' O ' ' A' ' 86' ' ' ASP . 1.8 p 53.38 23.16 3.17 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.878 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' MET . . . . . 0.431 ' O ' ' O ' ' A' ' 85' ' ' LYS . 0.2 OUTLIER -150.49 143.67 24.88 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.915 179.925 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 4.4 mt -108.5 136.53 43.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.166 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' TRP . . . . . 0.631 ' N ' ' CD1' ' A' ' 90' ' ' TRP . 0.1 OUTLIER -131.18 140.86 49.98 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.74 179.955 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -79.57 52.67 1.44 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.699 179.887 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . 0.456 ' HA ' ' HA ' ' A' ' 104' ' ' CYS . 70.9 m -41.43 111.29 0.21 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.087 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' THR . . . . . 0.426 ' O ' ' N ' ' A' ' 95' ' ' ILE . 51.9 m -98.34 132.87 43.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.894 179.83 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 43.5 t -65.89 61.98 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.935 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.426 ' N ' ' O ' ' A' ' 93' ' ' THR . 2.5 mt -69.62 105.23 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.205 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -142.56 -119.23 1.43 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.635 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.41 ' HA ' ' HG3' ' A' ' 64' ' ' GLU . . . 67.47 -74.35 0.07 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.831 0.348 . . . . 0.0 110.981 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -128.64 80.41 0.36 Allowed Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.827 -0.702 . . . . 0.0 112.318 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 2.2 mtt-85 62.75 13.35 6.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.811 0.339 . . . . 0.0 110.675 -179.795 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . 0.453 ' O ' ' HB3' ' A' ' 101' ' ' ARG . . . -43.72 -52.09 6.66 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.601 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.453 ' HB3' ' O ' ' A' ' 100' ' ' GLY . 0.0 OUTLIER 68.39 112.44 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.806 0.336 . . . . 0.0 110.73 -179.945 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . 0.43 ' C ' ' O ' ' A' ' 101' ' ' ARG . 2.3 mp -34.95 151.53 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.224 -179.883 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 4.7 t -146.04 128.91 16.36 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.831 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . 0.456 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 70.9 m -111.66 138.29 48.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.096 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -144.46 140.73 29.12 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.891 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.511 HD13 ' CZ3' ' A' ' 90' ' ' TRP . 2.8 mp -82.0 114.16 22.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.106 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -113.48 143.82 43.87 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.165 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 7.0 p-10 -123.61 115.57 21.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.949 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.248 0.992 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.88 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo . . . . . 0 N--CA 1.465 -0.193 0 CA-C-O 120.827 0.261 . . . . 0.0 112.206 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . 0.417 ' C ' ' SG ' ' A' ' 21' ' ' CYS . . . 160.99 -153.26 24.06 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.482 -179.833 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.417 ' SG ' ' C ' ' A' ' 20' ' ' GLY . 0.0 OUTLIER -159.82 93.0 1.06 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.844 0.354 . . . . 0.0 110.828 179.985 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.456 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 6.5 t80 -96.26 101.34 12.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.96 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.494 ' OD2' ' CE2' ' A' ' 54' ' ' PHE . 9.5 t70 -128.4 133.72 48.66 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.858 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 45.6 t30 51.66 28.44 4.77 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.015 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 86.61 -2.22 87.28 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.519 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.577 ' HB3' ' CZ ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -95.7 137.84 34.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.831 0.348 . . . . 0.0 110.95 179.913 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 -114.37 85.76 2.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.906 -179.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.577 ' CZ ' ' HB3' ' A' ' 26' ' ' LYS . 2.3 m-85 -79.64 176.48 9.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.961 -179.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.513 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 1.2 tt0 -104.09 136.91 42.84 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.56 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.475 HG23 ' ND2' ' A' ' 31' ' ' ASN . 3.8 mp -40.76 146.85 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.33 -179.877 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.475 ' ND2' HG23 ' A' ' 30' ' ' ILE . 69.7 m-80 67.9 10.68 7.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.303 179.71 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.513 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 59.9 tt0 -94.62 149.29 21.39 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.806 0.336 . . . . 0.0 110.828 179.79 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -113.38 147.19 38.2 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.209 -179.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . 0.501 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 42.6 p90 -157.27 -164.45 1.59 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.494 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -128.89 122.73 30.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.86 0.362 . . . . 0.0 111.191 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.454 ' O ' HD22 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -114.92 131.19 56.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.546 179.751 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.4 m -99.83 129.41 45.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.681 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.467 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 1.5 t80 -145.14 112.59 6.18 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.854 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.467 ' HB2' ' O ' ' A' ' 38' ' ' TYR . 0.3 OUTLIER 77.74 56.97 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.658 -179.924 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 48.91 28.94 7.77 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.357 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 34.7 m-80 -140.45 138.85 35.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.795 0.331 . . . . 0.0 110.995 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.496 ' C ' ' CD1' ' A' ' 43' ' ' LEU . . . -87.81 126.43 35.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.169 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.496 ' CD1' ' C ' ' A' ' 42' ' ' ALA . 0.0 OUTLIER -124.34 123.03 39.31 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.306 -0.407 . . . . 0.0 111.175 -179.965 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.467 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.7 t -67.15 133.24 31.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.337 -0.392 . . . . 0.0 109.972 179.17 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.571 ' SG ' ' CD1' ' A' ' 54' ' ' PHE . 1.6 m -115.0 167.35 10.88 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.05 0.452 . . . . 0.0 111.76 -179.037 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.497 ' O ' ' CE1' ' A' ' 48' ' ' TYR . 7.2 m -157.96 118.34 3.39 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.773 -0.648 . . . . 0.0 110.697 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.472 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 12.4 t -78.27 136.05 37.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.207 -179.584 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.497 ' CE1' ' O ' ' A' ' 46' ' ' THR . 5.4 m-85 -111.07 -32.29 6.84 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.908 179.848 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.431 ' HA3' HG21 ' A' ' 30' ' ' ILE . . . 76.6 -170.82 54.98 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.486 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . 0.526 ' O ' ' CB ' ' A' ' 51' ' ' SER . . . 54.4 25.46 34.08 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.522 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' SER . . . . . 0.526 ' CB ' ' O ' ' A' ' 50' ' ' GLY . 3.2 m 85.06 -13.29 0.67 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.835 0.35 . . . . 0.0 111.157 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.455 ' HB2' ' HB2' ' A' ' 48' ' ' TYR . 60.7 mtt180 -57.58 -28.85 63.97 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.929 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 58.74 168.65 0.2 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.454 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.571 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 7.6 p90 -84.11 146.66 27.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.765 0.316 . . . . 0.0 110.815 -179.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -101.95 -47.82 4.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.018 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.473 ' HA ' ' HA ' ' A' ' 45' ' ' CYS . 0.1 OUTLIER 71.31 159.42 0.21 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.813 -179.881 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . 0.4 ' CG ' ' N ' ' A' ' 58' ' ' SER . 1.5 tp10 -141.65 -93.5 0.14 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.15 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.488 ' HA ' ' HA ' ' A' ' 43' ' ' LEU . 21.7 m -171.63 160.96 5.98 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.88 0.371 . . . . 0.0 111.02 -179.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 11.7 tmtt? . . . . . 0 C--N 1.328 -0.339 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.804 179.907 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.434 ' HG3' ' N ' ' A' ' 64' ' ' GLU . 1.9 tt0 . . . . . 0 N--CA 1.455 -0.221 0 CA-C-O 120.919 0.39 . . . . 0.0 110.544 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.434 ' N ' ' HG3' ' A' ' 63' ' ' GLU . 13.6 tt0 -169.46 46.07 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.933 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -142.15 166.5 24.54 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.211 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.511 ' HA ' ' CA ' ' A' ' 98' ' ' GLY . 3.8 m -149.95 -176.03 5.28 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.917 -179.846 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.559 ' CE2' ' HA2' ' A' ' 72' ' ' GLY . 27.8 t80 -178.61 93.62 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.887 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . 0.468 ' O ' ' O ' ' A' ' 69' ' ' LYS . 13.6 t70 -93.98 38.18 1.08 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.928 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.468 ' HA ' ' CE1' ' A' ' 67' ' ' PHE . 1.3 pttt 36.6 -159.73 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.953 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . 0.466 ' HB2' ' O ' ' A' ' 69' ' ' LYS . 21.9 m-85 73.32 -54.71 0.69 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.964 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 13.2 p -135.14 12.97 3.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.027 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . 0.559 ' HA2' ' CE2' ' A' ' 67' ' ' PHE . . . 46.43 24.63 1.72 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.564 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . 0.452 ' HB3' ' CE1' ' A' ' 75' ' ' TYR . 1.1 t-20 -72.21 109.6 6.07 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.758 0.314 . . . . 0.0 110.929 -179.933 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 92.3 m -78.48 112.11 15.2 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.015 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.659 ' CE2' ' CE2' ' A' ' 81' ' ' TYR . 9.1 m-85 -94.37 -175.77 3.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.898 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . 0.43 ' HD2' ' HA ' ' A' ' 76' ' ' ARG . 0.2 OUTLIER -104.61 126.46 51.72 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.819 179.991 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.433 ' HA ' ' HB3' ' A' ' 94' ' ' CYS . 31.9 t -62.62 -14.94 14.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.213 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -102.39 16.2 55.4 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.475 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -155.69 163.74 39.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.812 0.339 . . . . 0.0 110.922 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 30.6 p -95.99 167.39 11.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.217 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . 0.659 ' CE2' ' CE2' ' A' ' 75' ' ' TYR . 15.6 p90 -146.2 131.68 18.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.858 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.52 ' OE2' ' CG2' ' A' ' 89' ' ' ILE . 0.8 OUTLIER -70.96 113.32 7.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.02 -179.951 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.508 ' HA ' ' NE ' ' A' ' 83' ' ' ARG . 0.7 OUTLIER -120.71 81.22 32.88 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.768 179.822 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_exo -44.58 116.6 1.15 Allowed 'Trans proline' 0 N--CA 1.465 -0.173 0 C-N-CA 122.877 2.385 . . . . 0.0 112.433 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -132.66 122.11 24.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.897 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 3.7 t0 72.84 -156.53 0.08 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.84 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.17 8.04 12.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.952 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -128.64 160.32 32.8 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.915 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.521 ' O ' ' CG2' ' A' ' 106' ' ' ILE . 2.6 mp -107.81 128.18 63.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.027 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' TRP . . . . . 0.5 ' CZ3' ' CD1' ' A' ' 106' ' ' ILE . 1.0 OUTLIER -122.21 136.5 54.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.981 -179.987 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -93.15 57.81 2.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.803 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . 0.46 ' HA ' ' HA ' ' A' ' 104' ' ' CYS . 0.7 OUTLIER -38.21 151.63 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.095 -179.94 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 88.7 m -128.2 128.71 45.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.977 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . 0.433 ' HB3' ' HA ' ' A' ' 77' ' ' VAL . 16.2 t -64.66 88.3 0.06 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.01 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.408 ' HB ' ' O ' ' A' ' 101' ' ' ARG . 0.8 OUTLIER -101.8 46.62 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.168 179.998 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 172.64 -159.6 30.37 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.476 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -90.98 63.65 5.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.836 0.351 . . . . 0.0 111.044 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . 0.511 ' CA ' ' HA ' ' A' ' 66' ' ' CYS . . . 68.12 10.36 59.15 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.489 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 171.59 51.32 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.838 0.351 . . . . 0.0 110.945 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -111.88 -62.13 0.46 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.371 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.408 ' O ' ' HB ' ' A' ' 95' ' ' ILE . 0.4 OUTLIER -141.45 38.89 1.71 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.95 0.405 . . . . 0.0 110.827 179.808 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . 0.463 HG22 ' OH ' ' A' ' 81' ' ' TYR . 2.7 mt -56.96 89.25 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.168 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 27.0 t -84.71 138.72 32.48 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.791 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . 0.46 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 0.5 OUTLIER -110.93 141.63 44.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.982 -179.931 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 1.5 t -156.89 121.55 4.48 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.054 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.521 ' CG2' ' O ' ' A' ' 89' ' ' ILE . 1.7 mp -66.48 138.84 22.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.086 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -64.65 106.2 1.13 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.167 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -105.61 111.68 24.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.876 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.252 -0.88 . . . . 0.0 110.971 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo . . . . . 0 C--O 1.232 0.223 0 CA-C-O 120.963 0.318 . . . . 0.0 112.391 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 73.11 -154.44 49.53 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.873 -0.679 . . . . 0.0 112.455 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 85.0 m -138.99 135.16 34.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.837 0.351 . . . . 0.0 110.922 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 47.7 t80 -110.3 119.84 40.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.877 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -167.73 151.61 6.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.916 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.491 ' O ' ' ND2' ' A' ' 24' ' ' ASN . 17.6 t30 55.35 51.03 13.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.908 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 47.56 23.26 2.07 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.482 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.539 ' HB3' ' CE2' ' A' ' 28' ' ' TYR . 0.1 OUTLIER -132.29 139.12 48.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.842 0.353 . . . . 0.0 110.865 -179.977 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -109.23 85.9 2.19 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.947 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.539 ' CE2' ' HB3' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -79.84 165.15 23.0 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.815 179.948 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.523 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 0.0 OUTLIER -100.25 162.33 13.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.741 179.806 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.411 ' HA ' ' SG ' ' A' ' 47' ' ' CYS . 3.5 mp -49.53 156.23 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.351 -179.868 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 56.86 19.65 4.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.066 179.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.523 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 10.1 tt0 -101.29 147.69 26.0 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.825 0.345 . . . . 0.0 110.91 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 14.2 mt-30 -116.75 145.46 43.47 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.016 -179.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . 0.581 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 42.0 p90 -150.35 168.88 22.79 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.785 179.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 76.2 tt0 -101.15 126.53 47.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.171 -179.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.454 ' HB2' ' SG ' ' A' ' 56' ' ' CYS . 1.5 mtp180 -119.4 176.95 5.1 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.674 179.847 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -144.61 132.46 21.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.701 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.461 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 0.6 OUTLIER -154.76 143.59 20.84 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.678 179.671 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.461 ' HB2' ' O ' ' A' ' 38' ' ' TYR . 3.4 mm? 66.76 22.51 10.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.484 -179.678 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 69.69 38.85 77.74 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.531 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -152.08 153.3 33.66 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-O 120.708 0.29 . . . . 0.0 110.984 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.5 ' O ' ' CD1' ' A' ' 43' ' ' LEU . . . -60.75 146.58 45.44 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.946 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.5 ' CD1' ' O ' ' A' ' 42' ' ' ALA . 4.3 mp -142.18 161.5 37.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.929 0.395 . . . . 0.0 111.364 -179.674 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.487 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.2 t -128.9 123.65 59.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.244 179.353 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.581 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 1.3 m -109.8 158.76 17.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.618 -179.263 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 24.7 m -146.38 119.53 8.86 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.797 179.644 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.521 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 28.7 t -74.16 143.69 45.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.158 -179.795 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.461 ' N ' ' O ' ' A' ' 53' ' ' GLY . 26.2 m-85 -119.4 -24.66 6.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.948 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 123.87 -169.07 15.98 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.453 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . 0.516 ' O ' ' CB ' ' A' ' 51' ' ' SER . . . -75.17 85.94 0.8 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.601 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' SER . . . . . 0.516 ' CB ' ' O ' ' A' ' 50' ' ' GLY . 0.3 OUTLIER 160.0 -62.91 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.823 0.344 . . . . 0.0 110.849 179.976 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -85.07 -29.94 24.49 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.024 -179.897 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . 0.461 ' O ' ' N ' ' A' ' 48' ' ' TYR . . . 70.34 -111.51 3.82 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.522 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.566 ' CE1' ' SG ' ' A' ' 45' ' ' CYS . 1.8 p90 -153.65 154.21 33.74 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.893 0.378 . . . . 0.0 110.886 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -133.2 93.96 3.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.622 179.777 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.487 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.4 OUTLIER -68.0 166.79 15.13 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.146 -179.673 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . 0.482 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 14.6 tt0 -152.75 -89.69 0.05 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.131 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.482 ' N ' ' HG2' ' A' ' 57' ' ' GLU . 0.1 OUTLIER -164.49 -167.18 1.22 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.976 179.953 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.41 ' HB2' HG23 ' A' ' 44' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.972 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.432 ' O ' ' HB2' ' A' ' 97' ' ' ALA . 2.8 tt0 . . . . . 0 N--CA 1.456 -0.16 0 CA-C-O 120.903 0.383 . . . . 0.0 110.452 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -66.57 -169.02 0.07 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.826 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 7.2 p 48.01 -177.56 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.18 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.412 ' SG ' ' HB2' ' A' ' 75' ' ' TYR . 18.5 p -150.12 -156.33 0.71 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.791 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.465 ' O ' ' N ' ' A' ' 69' ' ' LYS . 12.6 t80 -168.32 81.77 0.17 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.891 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -52.74 87.08 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.872 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.465 ' N ' ' O ' ' A' ' 67' ' ' PHE . 2.0 pttt -52.67 -29.84 28.68 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.862 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . 0.403 ' C ' ' O ' ' A' ' 69' ' ' LYS . 8.3 m-30 -38.4 -56.49 1.24 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.903 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -122.58 -8.08 8.55 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.09 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 80.12 69.67 1.38 Allowed Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.511 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 12.8 m120 -122.37 -162.88 1.03 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.942 0.401 . . . . 0.0 110.965 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 18.0 m -144.39 105.21 4.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.976 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.412 ' HB2' ' SG ' ' A' ' 66' ' ' CYS . 19.3 m-85 -120.68 160.38 23.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.747 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -91.58 146.56 23.69 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.797 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 93.7 t -45.59 -37.74 2.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.096 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -95.39 14.8 64.46 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.515 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -107.52 100.69 10.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.922 0.391 . . . . 0.0 110.996 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 64.6 p -73.98 143.6 45.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.205 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . 0.421 ' CD2' ' O ' ' A' ' 81' ' ' TYR . 42.2 p90 -133.88 109.98 9.42 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.784 179.842 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -50.4 168.24 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.083 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -167.66 86.58 0.75 Allowed Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.801 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.425 ' HA ' HG12 ' A' ' 89' ' ' ILE . 49.4 Cg_endo -69.13 91.94 0.45 Allowed 'Trans proline' 0 C--O 1.232 0.195 0 C-N-CA 122.734 2.289 . . . . 0.0 112.402 -179.89 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 2.8 mttt -128.26 132.54 48.72 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.788 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 4.8 t0 74.95 10.23 3.85 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.884 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 66.3 30.4 9.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.852 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' MET . . . . . 0.456 ' HG2' HD13 ' A' ' 106' ' ' ILE . 2.3 tpt -120.45 -29.91 4.67 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.919 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.448 ' C ' ' CD1' ' A' ' 90' ' ' TRP . 84.4 mt 58.77 129.02 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.057 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' TRP . . . . . 0.589 ' N ' ' CD1' ' A' ' 90' ' ' TRP . 0.7 OUTLIER -136.15 132.49 36.07 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.852 -179.992 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.468 ' N ' ' O ' ' A' ' 105' ' ' THR . 0.5 OUTLIER -70.77 62.22 0.27 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.865 -179.972 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 64.2 m -51.48 136.74 25.39 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.998 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' THR . . . . . 0.517 ' O ' ' N ' ' A' ' 95' ' ' ILE . 0.2 OUTLIER -126.84 124.83 40.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.912 179.872 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -60.37 73.14 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.938 -179.897 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.517 ' N ' ' O ' ' A' ' 93' ' ' THR . 1.9 mt -88.89 58.81 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.238 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 174.24 161.85 24.91 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.481 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.432 ' HB2' ' O ' ' A' ' 63' ' ' GLU . . . -107.71 53.32 0.69 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.817 0.341 . . . . 0.0 110.961 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 95.75 -3.39 65.21 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.523 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.456 ' HG2' ' O ' ' A' ' 99' ' ' ARG . 1.9 ttm180 -173.23 40.83 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.859 0.361 . . . . 0.0 110.94 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . 0.453 ' O ' ' HB3' ' A' ' 101' ' ' ARG . . . -94.82 -79.85 1.47 Allowed Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.43 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.453 ' HB3' ' O ' ' A' ' 100' ' ' GLY . 0.0 OUTLIER 171.33 51.33 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.758 0.313 . . . . 0.0 110.9 179.992 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . 0.463 ' N ' HD12 ' A' ' 102' ' ' ILE . 3.5 mm -37.11 97.88 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.143 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' SER . . . . . 0.402 ' N ' ' O ' ' A' ' 101' ' ' ARG . 3.4 t -71.92 157.49 37.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.948 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 89.5 m -150.03 114.37 5.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.924 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' THR . . . . . 0.468 ' O ' ' N ' ' A' ' 91' ' ' ASP . 8.8 t -129.63 154.27 47.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.19 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.577 HD13 ' CH2' ' A' ' 90' ' ' TRP . 2.9 mt -87.72 125.23 41.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.019 179.828 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -173.53 117.69 0.27 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.124 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -128.89 165.84 20.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.926 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 12.1 ttp180 . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.204 -0.903 . . . . 0.0 110.927 179.928 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo . . . . . 0 N--CA 1.463 -0.318 0 CA-C-O 120.739 0.224 . . . . 0.0 112.4 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 114.37 162.91 14.41 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.499 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 86.9 m -116.54 115.26 25.43 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.808 0.337 . . . . 0.0 110.863 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -91.26 114.35 26.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.951 -179.955 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -154.59 156.05 35.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.963 -179.906 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 46.1 t30 52.36 27.11 4.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.955 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 76.07 1.02 67.05 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.545 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 2.5 mptt -110.96 148.59 32.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.831 0.348 . . . . 0.0 110.939 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 4.5 t-160 -117.15 88.81 2.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.863 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -79.64 -175.19 4.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.96 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.506 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 10.6 tt0 -105.92 156.55 18.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.895 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.441 ' HA ' ' SG ' ' A' ' 47' ' ' CYS . 3.3 mp -52.8 156.59 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.34 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 59.42 14.22 3.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.981 179.866 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.506 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 21.1 tt0 -96.06 155.09 16.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.933 179.938 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 40.4 mt-30 -122.87 134.65 54.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.981 -179.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . 0.576 ' CZ2' ' HB3' ' A' ' 45' ' ' CYS . 23.4 p90 -136.01 175.07 9.93 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.964 179.827 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -100.37 127.6 46.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.036 -179.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.522 ' O ' ' CB ' ' A' ' 43' ' ' LEU . 17.5 tpt85 -128.31 162.75 26.33 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.643 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -140.54 129.96 23.93 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.562 -179.813 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.461 ' CD1' ' HB2' ' A' ' 39' ' ' LEU . 12.3 t80 -127.73 119.25 25.38 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.914 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.461 ' HB2' ' CD1' ' A' ' 38' ' ' TYR . 3.4 tp 76.26 13.29 2.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.722 -179.824 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 84.66 39.45 8.83 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.7 180.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.42 ' O ' ' C ' ' A' ' 42' ' ' ALA . 7.5 m-80 -141.67 125.52 17.06 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.734 0.302 . . . . 0.0 110.846 179.866 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.464 ' O ' ' CD1' ' A' ' 43' ' ' LEU . . . -35.55 147.77 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.946 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.522 ' CB ' ' O ' ' A' ' 36' ' ' ARG . 1.1 tp -159.28 150.7 20.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.224 -179.608 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.475 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 3.1 t -122.37 135.48 62.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.358 179.541 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.576 ' HB3' ' CZ2' ' A' ' 34' ' ' TRP . 0.7 OUTLIER -118.69 157.13 28.05 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.396 -179.429 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.434 ' O ' ' CE1' ' A' ' 48' ' ' TYR . 76.1 m -140.44 116.17 10.24 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.97 179.799 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.523 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 19.4 t -75.59 132.38 40.61 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.979 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.434 ' CE1' ' O ' ' A' ' 46' ' ' THR . 7.3 m-85 -105.52 -26.04 12.06 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.749 179.883 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.404 ' HA3' HG21 ' A' ' 30' ' ' ILE . . . 87.02 163.24 38.63 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.551 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 58.79 -129.99 50.4 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.529 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -96.48 -13.06 23.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.848 0.356 . . . . 0.0 110.849 -179.918 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -50.41 -33.49 20.95 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.96 -179.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 63.72 161.02 0.35 Allowed Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.785 -0.722 . . . . 0.0 112.537 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.574 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 4.0 p90 -91.45 161.36 15.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.859 0.361 . . . . 0.0 110.851 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -139.9 120.69 14.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.871 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.475 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.8 OUTLIER -90.95 168.2 11.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.938 -179.911 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -176.23 -178.23 0.96 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.978 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 17.3 m -80.09 160.01 25.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.91 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 3.1 mttt . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.804 179.915 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.447 -0.591 0 CA-C-O 120.823 0.344 . . . . 0.0 111.129 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.412 ' O ' ' O ' ' A' ' 65' ' ' THR . 0.1 OUTLIER -68.05 -166.89 0.07 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.911 179.959 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.412 ' O ' ' O ' ' A' ' 64' ' ' GLU . 6.2 p 46.45 -175.34 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.014 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.477 ' O ' HG23 ' A' ' 74' ' ' THR . 0.5 OUTLIER -160.91 -175.17 4.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.108 -179.877 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -130.08 143.54 50.85 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.836 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . 0.511 ' O ' ' N ' ' A' ' 72' ' ' GLY . 0.5 OUTLIER -117.3 81.75 1.7 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.914 -179.925 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 28.2 pttt -44.64 -33.54 1.85 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.834 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 4.1 m-30 -44.44 -61.3 1.58 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.809 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -134.03 27.31 3.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.978 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . 0.511 ' N ' ' O ' ' A' ' 68' ' ' ASP . . . 46.51 81.86 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.484 179.926 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . 0.549 ' HB3' ' CZ ' ' A' ' 75' ' ' TYR . 2.5 m120 -148.18 111.86 5.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.824 0.345 . . . . 0.0 110.961 -179.922 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' THR . . . . . 0.477 HG23 ' O ' ' A' ' 66' ' ' CYS . 18.7 m -80.21 125.97 30.52 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.954 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.549 ' CZ ' ' HB3' ' A' ' 73' ' ' ASN . 78.2 m-85 -121.26 175.78 5.96 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.634 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 22.1 mtm180 -92.1 154.63 18.6 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.887 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 89.9 t -57.35 -63.32 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.127 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -83.4 51.59 4.6 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.474 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 10.7 t0 -147.55 125.11 11.72 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.779 0.323 . . . . 0.0 110.92 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 44.6 p -86.23 150.24 24.52 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.068 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . 0.437 ' CD2' ' O ' ' A' ' 81' ' ' TYR . 47.2 p90 -148.97 114.54 5.61 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.977 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.465 ' CG ' ' OD1' ' A' ' 91' ' ' ASP . 18.6 mt-10 -65.77 141.56 58.27 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.845 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.21 86.37 31.06 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.798 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 77.7 Cg_exo -49.93 96.8 0.03 OUTLIER 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.723 2.282 . . . . 0.0 112.354 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -121.33 136.5 54.96 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.984 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 53.2 -155.37 0.2 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.946 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 7.7 t -89.2 43.96 1.18 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.996 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' MET . . . . . 0.555 ' O ' ' CD1' ' A' ' 90' ' ' TRP . 2.9 ttm -175.67 126.16 0.23 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.952 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 9.1 mt -87.03 128.71 39.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.037 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' TRP . . . . . 0.555 ' CD1' ' O ' ' A' ' 88' ' ' MET . 1.2 m95 -119.92 120.45 36.42 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.912 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.465 ' OD1' ' CG ' ' A' ' 82' ' ' GLU . 0.2 OUTLIER -60.58 87.85 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.844 179.94 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 25.4 m -67.77 123.36 20.3 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.985 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' THR . . . . . 0.417 ' O ' ' HA ' ' A' ' 102' ' ' ILE . 82.5 m -112.23 136.45 51.63 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.914 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . 0.402 ' N ' HG21 ' A' ' 93' ' ' THR . 44.2 t -70.08 62.58 0.21 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.053 -179.727 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.471 ' HB ' ' O ' ' A' ' 101' ' ' ARG . 2.7 mt -71.4 96.48 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.087 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.52 ' O ' ' N ' ' A' ' 98' ' ' GLY . . . 123.85 103.98 1.61 Allowed Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.363 -179.924 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -49.29 85.28 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.795 0.331 . . . . 0.0 111.356 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . 0.52 ' N ' ' O ' ' A' ' 96' ' ' GLY . . . 119.24 10.98 7.7 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.603 -0.808 . . . . 0.0 113.004 179.693 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.489 ' CB ' ' O ' ' A' ' 98' ' ' GLY . 0.1 OUTLIER 83.29 107.91 0.06 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.922 0.392 . . . . 0.0 110.838 -179.982 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . 0.47 ' O ' ' HG3' ' A' ' 101' ' ' ARG . . . -150.11 -38.46 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.393 179.86 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.471 ' O ' ' HB ' ' A' ' 95' ' ' ILE . 0.7 OUTLIER -146.02 38.58 1.09 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.71 0.291 . . . . 0.0 111.041 179.913 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . 0.43 HG22 ' OH ' ' A' ' 81' ' ' TYR . 17.6 mt -47.59 90.69 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.18 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' SER . . . . . 0.462 ' N ' ' O ' ' A' ' 101' ' ' ARG . 0.2 OUTLIER -87.24 149.33 24.66 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.916 179.926 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 3.6 m -134.6 109.22 8.51 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.921 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -106.27 143.2 34.74 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.088 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.549 HD12 ' CZ3' ' A' ' 90' ' ' TRP . 2.5 mp -66.48 94.34 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.117 179.938 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -128.32 113.13 15.23 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.152 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . 0.418 ' O ' ' HB3' ' A' ' 109' ' ' ARG . 21.9 t-20 -175.4 68.16 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.958 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . 0.418 ' HB3' ' O ' ' A' ' 108' ' ' ASN . 4.6 ptp180 . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.899 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo . . . . . 0 C--O 1.231 0.159 0 CA-C-O 120.778 0.241 . . . . 0.0 112.274 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 142.21 -171.88 24.43 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.55 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -159.99 110.42 1.88 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.817 0.341 . . . . 0.0 110.92 -179.94 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -90.05 140.49 29.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.916 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.451 ' OD1' ' O ' ' A' ' 26' ' ' LYS . 1.1 p-10 -126.98 -160.95 1.03 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.848 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.432 ' C ' ' O ' ' A' ' 23' ' ' ASP . 0.7 OUTLIER -34.87 -52.25 0.53 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.009 -0.542 . . . . 0.0 111.068 -179.882 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -163.5 22.81 0.18 Allowed Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.62 180.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.522 ' HA ' ' CE ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -128.95 144.82 51.3 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.798 0.332 . . . . 0.0 110.969 179.797 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 4.2 t-160 -119.66 85.42 2.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.302 -179.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.526 ' CE2' ' CG ' ' A' ' 34' ' ' TRP . 96.6 m-85 -85.01 166.3 16.83 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.833 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.514 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 0.0 OUTLIER -91.86 149.4 21.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.608 179.705 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.516 ' CG2' ' O ' ' A' ' 48' ' ' TYR . 3.8 mp -41.58 147.14 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 120.851 0.357 . . . . 0.0 111.191 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.481 ' N ' HG21 ' A' ' 30' ' ' ILE . 70.4 m-20 67.17 11.47 8.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.301 179.813 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.514 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 10.2 tp60 -99.24 145.06 27.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.799 0.333 . . . . 0.0 110.613 179.66 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -112.63 156.51 22.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.173 -179.714 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . 0.553 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 48.9 p90 -160.87 173.99 14.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.887 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.437 ' HG3' ' O ' ' A' ' 43' ' ' LEU . 0.1 OUTLIER -99.92 141.78 32.29 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.113 -179.823 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.52 ' O ' ' N ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -140.36 169.81 16.98 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.724 179.886 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -137.45 125.76 23.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.769 -179.762 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.422 ' HB2' HD22 ' A' ' 43' ' ' LEU . 6.1 t80 -119.6 136.84 54.2 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.681 179.718 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.4 tp 64.24 13.1 7.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.693 -179.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 85.71 29.65 26.03 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.933 -0.651 . . . . 0.0 112.743 179.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -133.39 145.67 50.54 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.784 0.326 . . . . 0.0 111.027 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.41 ' O ' HD11 ' A' ' 43' ' ' LEU . . . -43.75 151.29 0.21 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.64 179.768 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.52 ' N ' ' O ' ' A' ' 36' ' ' ARG . 4.4 tp -170.24 165.59 8.96 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.951 0.405 . . . . 0.0 111.379 -179.615 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.484 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 17.7 t -132.31 151.97 35.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.398 179.459 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.553 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 0.5 OUTLIER -129.26 153.56 47.67 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.903 0.382 . . . . 0.0 111.423 -179.564 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 69.4 m -138.4 131.96 30.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.757 179.715 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.478 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 21.0 t -92.86 161.5 14.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.042 -179.728 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.516 ' O ' ' CG2' ' A' ' 30' ' ' ILE . 36.8 m-85 -138.62 -43.99 0.49 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.771 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.424 ' CA ' HG23 ' A' ' 30' ' ' ILE . . . 104.2 167.67 24.89 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.469 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 65.95 -113.38 5.7 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.613 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -104.29 -24.65 13.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.783 0.325 . . . . 0.0 110.992 -179.875 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.461 ' HB3' ' HB2' ' A' ' 48' ' ' TYR . 0.1 OUTLIER -54.99 -36.33 65.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.847 -179.952 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 63.48 -103.89 0.75 Allowed Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.549 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.552 ' CE1' ' SG ' ' A' ' 45' ' ' CYS . 1.4 p90 -158.58 166.69 31.51 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.854 0.359 . . . . 0.0 111.002 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -149.07 112.23 4.92 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.658 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.484 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.6 OUTLIER -83.4 170.93 13.99 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.121 -179.752 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 171.99 178.78 0.07 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.965 -179.879 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.408 ' HA ' HD12 ' A' ' 43' ' ' LEU . 1.3 p -59.36 173.42 0.51 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.018 -179.975 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.045 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 . . . . . 0 N--CA 1.455 -0.198 0 CA-C-O 120.865 0.364 . . . . 0.0 110.575 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.458 ' HG2' ' HG2' ' A' ' 76' ' ' ARG . 0.0 OUTLIER -92.01 117.18 29.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.894 -179.919 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -171.23 163.94 7.18 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.239 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 175.86 171.65 0.36 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.876 -180.0 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -179.28 94.0 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.963 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . 0.571 ' HB2' ' CE2' ' A' ' 75' ' ' TYR . 38.7 t0 -69.02 81.65 0.31 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.731 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 7.3 pttm -41.75 -31.31 0.29 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.907 -179.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 8.0 m-30 -51.64 -27.36 11.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.759 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 24.0 p -137.7 -54.47 0.67 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.087 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 126.98 4.06 6.14 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.56 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . 0.506 ' HB3' ' CE1' ' A' ' 75' ' ' TYR . 2.2 m120 -70.95 149.29 46.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.835 0.35 . . . . 0.0 110.943 -179.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 91.7 m -103.54 117.11 33.69 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.992 179.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.571 ' CE2' ' HB2' ' A' ' 68' ' ' ASP . 6.5 m-85 -105.79 -160.51 0.75 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.806 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . 0.458 ' HG2' ' HG2' ' A' ' 64' ' ' GLU . 0.0 OUTLIER -142.05 133.35 26.4 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.721 179.839 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 55.0 t -49.97 -26.21 2.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.166 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -89.12 21.79 26.07 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.418 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -145.95 135.05 22.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.801 0.334 . . . . 0.0 111.083 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 3.2 p -107.2 171.92 7.11 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.176 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 49.0 p90 -165.28 150.11 9.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.869 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -87.47 133.31 33.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.08 -179.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 20.3 ttp180 -132.95 73.02 76.21 Favored Pre-proline 0 C--N 1.327 -0.385 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.708 179.712 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_exo -46.5 152.34 1.54 Allowed 'Trans proline' 0 C--N 1.342 0.219 0 C-N-CA 122.797 2.332 . . . . 0.0 112.589 -179.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 5.7 tptp -178.77 160.34 1.15 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.822 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 54.03 35.6 22.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.921 -179.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.9 m 60.8 48.17 7.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.868 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -169.68 160.51 8.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.823 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 2.5 mp -100.12 133.66 42.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.983 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' TRP . . . . . 0.524 ' N ' ' CD1' ' A' ' 90' ' ' TRP . 1.4 m95 -134.77 112.78 11.02 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.93 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -68.36 80.99 0.25 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.917 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . 0.421 ' HA ' ' HA ' ' A' ' 104' ' ' CYS . 0.6 OUTLIER -54.85 178.79 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.896 179.938 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 97.5 m -157.23 131.2 8.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.095 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 9.2 t -72.25 74.71 0.98 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 -179.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.542 ' CG2' ' CA ' ' A' ' 100' ' ' GLY . 1.0 OUTLIER -78.77 115.64 21.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.369 -179.94 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -149.45 97.5 0.18 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.512 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -159.59 61.26 0.38 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.859 0.361 . . . . 0.0 110.994 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . 0.489 ' O ' ' CB ' ' A' ' 99' ' ' ARG . . . 72.28 8.94 71.66 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.54 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.489 ' CB ' ' O ' ' A' ' 98' ' ' GLY . 0.0 OUTLIER 161.24 45.56 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.904 0.383 . . . . 0.0 111.012 -179.985 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . 0.542 ' CA ' ' CG2' ' A' ' 95' ' ' ILE . . . -89.58 -52.61 2.62 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.386 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.484 ' CD ' ' O ' ' A' ' 100' ' ' GLY . 0.0 OUTLIER 48.56 105.7 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.816 0.341 . . . . 0.0 111.107 179.926 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . 0.42 ' C ' ' O ' ' A' ' 101' ' ' ARG . 3.6 mp -36.92 130.82 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.922 179.755 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' SER . . . . . 0.4 ' O ' ' HA ' ' A' ' 92' ' ' CYS . 13.2 t -127.66 159.96 33.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.047 -179.785 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . 0.421 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 0.5 OUTLIER -134.15 127.45 32.07 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.801 179.94 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' THR . . . . . 0.453 ' CG2' ' O ' ' A' ' 105' ' ' THR . 4.8 t -148.15 121.15 8.81 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.271 -179.86 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.463 HG13 ' CE3' ' A' ' 90' ' ' TRP . 2.7 mt -44.15 151.06 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.056 179.902 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . 0.426 ' N ' HG22 ' A' ' 106' ' ' ILE . . . -88.15 122.81 32.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.14 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -60.4 145.8 46.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.969 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 2.9 ttp180 . . . . . 0 C--O 1.25 1.088 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.893 179.984 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo . . . . . 0 N--CA 1.465 -0.172 0 CA-C-O 120.842 0.268 . . . . 0.0 112.12 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . 0.41 ' CA ' HD13 ' A' ' 30' ' ' ILE . . . 101.45 137.62 9.81 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.474 -179.911 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.423 ' O ' ' CD2' ' A' ' 27' ' ' HIS . 2.0 m -84.23 151.25 24.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.781 0.324 . . . . 0.0 110.854 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 82.7 t80 -157.61 109.95 2.39 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.907 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.449 ' OD1' ' N ' ' A' ' 24' ' ' ASN . 38.8 t0 -151.48 157.85 42.86 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.923 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.449 ' N ' ' OD1' ' A' ' 23' ' ' ASP . 4.5 t-20 56.54 26.43 11.0 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.932 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 76.17 7.35 84.49 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.465 179.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.426 ' HB3' ' CE2' ' A' ' 28' ' ' TYR . 0.1 OUTLIER -116.02 141.38 48.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.856 0.36 . . . . 0.0 110.897 179.946 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . 0.423 ' CD2' ' O ' ' A' ' 21' ' ' CYS . 3.3 t-160 -113.58 89.29 3.05 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.041 -179.911 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.426 ' CE2' ' HB3' ' A' ' 26' ' ' LYS . 94.8 m-85 -87.17 145.19 26.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.806 179.899 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.511 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 10.4 tt0 -62.97 151.68 38.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.091 179.629 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.468 ' HA ' ' SG ' ' A' ' 47' ' ' CYS . 19.8 mm -50.56 144.28 2.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.935 0.397 . . . . 0.0 110.827 -179.779 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.461 ' HB2' ' O ' ' A' ' 30' ' ' ILE . 5.4 m-20 71.23 3.74 4.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.121 -179.808 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.511 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 29.7 tp60 -80.01 151.14 30.14 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.709 179.582 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.486 ' CG ' HG21 ' A' ' 46' ' ' THR . 25.2 mt-30 -115.37 142.78 46.23 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.783 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . 0.405 ' CZ3' ' HB2' ' A' ' 47' ' ' CYS . 40.6 p90 -145.45 171.3 14.84 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.943 0.401 . . . . 0.0 111.072 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 13.8 tm-20 -100.66 140.28 35.16 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.227 -179.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -137.18 -167.89 2.19 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.362 179.714 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.559 ' CG2' ' N ' ' A' ' 38' ' ' TYR . 1.8 t -151.2 -51.77 0.13 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.679 0.276 . . . . 0.0 111.55 179.791 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.559 ' N ' ' CG2' ' A' ' 37' ' ' THR . 18.4 t80 44.86 104.97 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.267 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.486 ' CB ' ' O ' ' A' ' 38' ' ' TYR . 1.7 tp 82.77 15.56 0.37 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.779 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 66.13 51.68 42.65 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.81 -0.709 . . . . 0.0 112.717 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.478 ' O ' ' HA ' ' A' ' 37' ' ' THR . 62.2 m-80 -150.95 129.28 12.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.609 0.242 . . . . 0.0 110.983 179.866 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.429 ' C ' ' O ' ' A' ' 41' ' ' ASN . . . -32.96 119.43 0.32 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.032 179.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.471 HD21 ' HB3' ' A' ' 38' ' ' TYR . 15.0 tp -145.13 146.19 31.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.208 -179.529 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.474 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 4.1 t -130.62 139.07 52.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.551 179.659 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.517 ' SG ' ' CD1' ' A' ' 54' ' ' PHE . 0.4 OUTLIER -123.84 150.45 44.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.291 -179.626 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.545 ' O ' ' CE1' ' A' ' 48' ' ' TYR . 24.1 m -134.74 118.64 17.31 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.85 179.803 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.468 ' SG ' ' HA ' ' A' ' 30' ' ' ILE . 38.1 t -71.01 152.96 43.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.977 0.418 . . . . 0.0 110.932 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.545 ' CE1' ' O ' ' A' ' 46' ' ' THR . 5.3 m-85 -125.78 -31.26 2.94 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.133 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.468 ' HA2' HD12 ' A' ' 30' ' ' ILE . . . 89.55 179.01 45.14 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.5 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 52.73 -113.63 2.91 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.469 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 5.9 m -111.33 -23.74 10.62 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.818 0.342 . . . . 0.0 110.939 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.452 ' HB2' ' HB2' ' A' ' 48' ' ' TYR . 55.8 mtm180 -50.76 -39.42 52.3 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.873 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . 0.445 ' O ' ' N ' ' A' ' 48' ' ' TYR . . . 70.53 -131.84 22.16 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.665 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.517 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 3.6 p90 -146.97 162.65 38.31 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.876 0.369 . . . . 0.0 110.961 -179.873 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.458 ' HB3' ' OH ' ' A' ' 48' ' ' TYR . 2.2 t30 -143.06 126.43 16.67 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.696 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.474 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 2.0 m -87.19 166.66 14.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.101 -179.864 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . 0.473 ' CG ' ' C ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER -171.32 135.58 0.96 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.901 -179.934 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.425 ' HA ' ' O ' ' A' ' 42' ' ' ALA . 0.1 OUTLIER -50.01 140.17 12.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.053 -179.99 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.783 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 . . . . . 0 N--CA 1.455 -0.216 0 CA-C-O 120.797 0.332 . . . . 0.0 110.614 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.451 ' O ' ' O ' ' A' ' 65' ' ' THR . 0.0 OUTLIER -176.97 161.34 1.93 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.033 -179.969 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.465 ' O ' ' HA ' ' A' ' 97' ' ' ALA . 2.8 p 46.14 -177.84 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.308 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 24.7 p -175.14 162.7 3.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.788 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.487 ' CB ' ' HA2' ' A' ' 98' ' ' GLY . 82.3 t80 -117.97 126.24 51.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.042 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -82.05 105.22 12.97 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.748 179.83 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.64 -1.21 17.96 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.162 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 3.8 m-30 -94.32 -25.13 17.13 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.843 0.354 . . . . 0.0 110.862 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 1.1 p -142.45 -47.96 0.34 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.226 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 113.75 39.99 1.04 Allowed Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.454 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . 0.475 ' HB3' ' CZ ' ' A' ' 75' ' ' TYR . 0.8 OUTLIER -113.1 120.28 40.76 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.803 0.335 . . . . 0.0 110.788 -179.968 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 41.7 m -69.28 128.51 36.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.013 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.475 ' CZ ' ' HB3' ' A' ' 73' ' ' ASN . 62.1 m-85 -130.97 -171.6 2.61 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.788 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 23.0 mtp85 -103.49 134.8 46.24 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.736 179.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 9.0 p -57.46 -22.98 18.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.138 -179.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -92.52 23.48 27.73 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.486 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -142.64 128.19 19.07 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.882 0.372 . . . . 0.0 110.886 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.491 ' OG1' ' N ' ' A' ' 81' ' ' TYR . 0.1 OUTLIER -101.29 176.1 5.36 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.061 179.993 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . 0.491 ' N ' ' OG1' ' A' ' 80' ' ' THR . 33.8 p90 -154.41 138.25 16.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.861 -179.873 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -69.96 136.57 50.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.006 0.432 . . . . 0.0 110.857 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.427 ' HD3' ' HA ' ' A' ' 83' ' ' ARG . 0.0 OUTLIER -154.14 93.83 2.9 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.83 -179.935 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -66.82 166.74 21.5 Favored 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.737 2.292 . . . . 0.0 112.282 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 178.45 158.73 0.51 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.888 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 38.7 t0 59.28 -89.71 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.861 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 10.4 p -156.34 25.37 0.35 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.942 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' MET . . . . . 0.448 ' O ' ' CD1' ' A' ' 90' ' ' TRP . 0.0 OUTLIER -154.15 152.61 30.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.985 -179.926 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 7.9 mt -92.07 130.6 40.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.054 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' TRP . . . . . 0.573 ' CE3' HG13 ' A' ' 106' ' ' ILE . 0.8 OUTLIER -128.38 129.93 46.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.883 -179.944 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -83.49 69.91 10.14 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.923 179.925 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . 0.453 ' HA ' ' O ' ' A' ' 103' ' ' SER . 0.8 OUTLIER -44.2 127.19 5.49 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.03 -179.954 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' THR . . . . . 0.507 ' O ' ' N ' ' A' ' 95' ' ' ILE . 6.0 m -105.59 120.64 42.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.985 179.815 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -58.38 77.63 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.949 -179.859 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.507 ' N ' ' O ' ' A' ' 93' ' ' THR . 1.8 mt -89.87 131.59 36.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.259 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 115.38 -142.29 17.51 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.539 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.465 ' HA ' ' O ' ' A' ' 65' ' ' THR . . . -163.27 43.76 0.11 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.864 0.364 . . . . 0.0 110.939 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . 0.487 ' HA2' ' CB ' ' A' ' 67' ' ' PHE . . . 93.43 12.6 57.0 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.537 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -167.77 38.05 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.818 0.342 . . . . 0.0 111.01 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . 0.419 ' O ' ' HB3' ' A' ' 101' ' ' ARG . . . -118.96 -91.67 1.4 Allowed Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.491 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.419 ' HB3' ' O ' ' A' ' 100' ' ' GLY . 0.0 OUTLIER 168.49 109.67 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.867 0.365 . . . . 0.0 110.875 -179.969 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . 0.477 HD13 ' N ' ' A' ' 102' ' ' ILE . 1.2 mm -69.69 74.64 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.153 -179.971 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' SER . . . . . 0.453 ' O ' ' HA ' ' A' ' 92' ' ' CYS . 13.4 t -41.99 156.56 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.893 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . 0.451 ' SG ' ' HB2' ' A' ' 90' ' ' TRP . 0.0 OUTLIER -138.7 97.25 3.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.902 -179.943 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 4.5 t -103.88 135.57 45.16 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.158 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.573 HG13 ' CE3' ' A' ' 90' ' ' TRP . 2.5 mp -48.99 145.07 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.011 179.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -71.35 98.43 1.77 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.086 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -137.2 136.37 38.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.909 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 5.5 mtt-85 . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.18 -0.914 . . . . 0.0 110.889 179.91 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo . . . . . 0 N--CA 1.464 -0.209 0 CA-C-O 120.856 0.273 . . . . 0.0 112.271 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . 0.462 ' HA2' HG13 ' A' ' 30' ' ' ILE . . . 106.77 -164.05 13.36 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.538 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.517 ' O ' ' CD2' ' A' ' 27' ' ' HIS . 0.2 OUTLIER -155.45 155.49 33.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.794 0.33 . . . . 0.0 110.845 -179.972 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -142.65 130.59 21.75 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.817 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.41 ' O ' ' N ' ' A' ' 26' ' ' LYS . 1.4 t0 -161.73 144.25 11.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.136 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.414 ' ND2' ' HE2' ' A' ' 26' ' ' LYS . 0.8 OUTLIER 44.81 28.79 0.38 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.232 179.782 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 85.25 -10.34 63.99 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.762 179.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.414 ' HE2' ' ND2' ' A' ' 24' ' ' ASN . 0.9 OUTLIER -89.85 140.37 29.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.872 0.367 . . . . 0.0 110.787 179.979 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . 0.517 ' CD2' ' O ' ' A' ' 21' ' ' CYS . 14.9 t-80 -120.1 92.34 3.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.257 -179.757 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.434 ' CE2' ' CD1' ' A' ' 34' ' ' TRP . 0.1 OUTLIER -83.43 165.24 19.38 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.765 179.713 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.526 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 8.7 tt0 -94.9 145.19 25.08 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.837 179.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.462 HG13 ' HA2' ' A' ' 20' ' ' GLY . 3.7 mp -48.91 150.81 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.349 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.402 ' N ' ' O ' ' A' ' 47' ' ' CYS . 78.8 m-20 59.84 17.24 6.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.125 179.74 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.526 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 1.1 tt0 -102.88 154.35 19.29 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.838 0.351 . . . . 0.0 110.934 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -120.32 138.71 53.55 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.901 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . 0.537 ' CZ3' ' HB2' ' A' ' 47' ' ' CYS . 31.3 p90 -146.36 -176.93 5.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.871 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -108.79 123.46 49.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.024 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.518 ' O ' ' CB ' ' A' ' 43' ' ' LEU . 0.5 OUTLIER -131.75 167.6 19.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.603 179.766 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.402 ' OG1' ' C ' ' A' ' 41' ' ' ASN . 1.6 t -134.23 137.11 44.11 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.919 179.836 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.488 ' O ' ' CB ' ' A' ' 39' ' ' LEU . 22.1 t80 -107.74 108.54 19.81 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.874 -179.837 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.488 ' CB ' ' O ' ' A' ' 38' ' ' TYR . 6.7 tp 82.36 -49.24 0.19 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.821 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 165.16 36.94 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.795 -0.716 . . . . 0.0 112.51 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.424 ' O ' ' C ' ' A' ' 42' ' ' ALA . 68.9 m-80 -141.08 128.78 21.55 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 120.735 0.303 . . . . 0.0 111.053 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.478 ' O ' ' CD1' ' A' ' 43' ' ' LEU . . . -36.16 150.94 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.908 179.856 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.518 ' CB ' ' O ' ' A' ' 36' ' ' ARG . 1.4 tp -167.64 153.6 7.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.906 0.384 . . . . 0.0 111.275 -179.734 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.496 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.3 t -119.81 123.03 70.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.192 179.35 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.492 ' HB2' ' CE2' ' A' ' 34' ' ' TRP . 85.2 m -104.15 159.1 15.97 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.636 -179.141 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.473 ' O ' ' CE1' ' A' ' 48' ' ' TYR . 6.6 m -140.36 116.6 10.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.712 179.639 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.537 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 6.4 t -82.33 133.7 35.24 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.228 -179.569 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.473 ' CE1' ' O ' ' A' ' 46' ' ' THR . 7.1 m-85 -117.38 -27.08 6.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.629 179.864 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 138.67 174.14 13.31 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.227 -179.807 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -75.34 64.62 2.45 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.439 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -173.02 -64.29 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.792 0.33 . . . . 0.0 111.003 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -67.39 -24.95 65.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.242 -179.773 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 70.97 134.79 0.11 Allowed Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.216 -179.746 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.57 ' CD1' ' O ' ' A' ' 54' ' ' PHE . 4.8 p90 -69.98 132.66 46.26 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.942 0.401 . . . . 0.0 111.304 -179.692 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -108.39 140.54 41.53 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.237 179.542 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.496 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 2.4 m -126.63 176.01 7.53 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.992 0.425 . . . . 0.0 111.491 -179.529 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 177.52 -171.57 0.1 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.73 -179.912 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -56.9 141.71 44.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.952 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.965 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.455 -0.219 0 CA-C-O 120.88 0.372 . . . . 0.0 110.573 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.459 ' O ' ' OG1' ' A' ' 65' ' ' THR . 0.0 OUTLIER 171.49 176.4 0.07 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.999 179.976 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.459 ' OG1' ' O ' ' A' ' 64' ' ' GLU . 17.5 p 60.86 -177.65 0.11 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.224 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 20.2 t 176.2 129.17 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.854 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.544 ' CE1' ' HA ' ' A' ' 69' ' ' LYS . 53.2 t80 -85.39 108.07 17.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.007 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . 0.464 ' O ' ' O ' ' A' ' 69' ' ' LYS . 1.2 t70 -81.34 85.75 6.37 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.737 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.544 ' HA ' ' CE1' ' A' ' 67' ' ' PHE . 0.3 OUTLIER -39.81 164.46 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.905 -179.941 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . 0.503 ' N ' ' CD1' ' A' ' 70' ' ' TYR . 2.0 m-30 83.95 -46.31 0.11 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.892 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -111.87 -42.04 3.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.131 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . 0.426 ' HA2' ' CE2' ' A' ' 67' ' ' PHE . . . 90.34 5.62 69.58 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.554 -179.963 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 65.9 m-80 -74.01 105.82 5.42 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.845 0.355 . . . . 0.0 110.906 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 26.5 m -54.43 118.03 3.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.013 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.476 ' CE2' ' HB3' ' A' ' 81' ' ' TYR . 17.2 m-30 -110.05 177.58 4.67 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.696 179.894 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . 0.434 ' HB2' ' HB2' ' A' ' 79' ' ' ASP . 0.6 OUTLIER -104.37 141.62 36.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.871 179.969 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.455 ' HA ' ' O ' ' A' ' 94' ' ' CYS . 9.0 p -47.8 -29.43 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.138 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . 0.416 ' N ' HG12 ' A' ' 77' ' ' VAL . . . -105.8 14.39 45.57 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.499 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . 0.434 ' HB2' ' HB2' ' A' ' 76' ' ' ARG . 8.9 t70 -112.23 110.92 21.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.896 0.379 . . . . 0.0 110.887 -179.913 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.455 HG23 ' OG1' ' A' ' 93' ' ' THR . 2.7 p -81.89 150.46 27.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.158 179.983 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . 0.476 ' HB3' ' CE2' ' A' ' 75' ' ' TYR . 11.6 p90 -123.17 -33.08 3.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.946 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.455 ' HB3' ' O ' ' A' ' 81' ' ' TYR . 30.7 tt0 76.44 165.75 0.25 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.92 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -172.39 107.57 0.35 Allowed Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.742 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo -68.94 89.6 0.44 Allowed 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.716 2.277 . . . . 0.0 112.352 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 10.3 mttt -111.54 137.06 49.87 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.919 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 68.24 9.01 6.96 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.004 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.0 p 69.97 13.19 7.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.947 179.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' MET . . . . . 0.405 ' O ' ' O ' ' A' ' 89' ' ' ILE . 0.0 OUTLIER -102.1 -23.32 14.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.96 -179.933 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.405 ' O ' ' O ' ' A' ' 88' ' ' MET . 2.9 mp 59.31 122.29 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.12 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' TRP . . . . . 0.508 ' O ' ' N ' ' A' ' 92' ' ' CYS . 4.5 m95 -131.94 109.74 10.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.959 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -57.77 79.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.663 179.82 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . 0.508 ' N ' ' O ' ' A' ' 90' ' ' TRP . 0.5 OUTLIER -82.65 152.51 25.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.069 -179.782 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' THR . . . . . 0.478 ' O ' ' N ' ' A' ' 95' ' ' ILE . 25.9 m -125.71 126.73 45.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.974 179.841 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . 0.463 ' HA ' HG21 ' A' ' 102' ' ' ILE . 0.3 OUTLIER -57.83 80.11 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.024 -179.896 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.478 ' N ' ' O ' ' A' ' 93' ' ' THR . 0.9 OUTLIER -97.57 141.43 15.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.199 179.975 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.419 ' HA3' ' HA3' ' A' ' 100' ' ' GLY . . . 127.36 162.74 11.23 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.436 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -96.94 57.92 1.55 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.78 0.324 . . . . 0.0 111.101 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . 0.48 ' O ' ' CB ' ' A' ' 99' ' ' ARG . . . 92.72 7.99 62.52 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.506 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.48 ' CB ' ' O ' ' A' ' 98' ' ' GLY . 0.0 OUTLIER 162.21 38.88 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.88 0.371 . . . . 0.0 110.836 -179.92 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . 0.441 ' C ' ' HG3' ' A' ' 101' ' ' ARG . . . -76.8 -86.96 0.37 Allowed Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.491 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.558 ' CD ' ' N ' ' A' ' 101' ' ' ARG . 0.0 OUTLIER -176.12 94.91 0.06 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.831 0.348 . . . . 0.0 110.996 179.875 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . 0.465 HD11 ' N ' ' A' ' 102' ' ' ILE . 2.4 mm -58.59 99.43 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.951 179.734 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' SER . . . . . 0.416 ' C ' ' SG ' ' A' ' 92' ' ' CYS . 1.4 t -73.06 125.51 27.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.128 -179.82 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . 0.461 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 59.2 m -108.32 164.17 12.55 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.834 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 3.2 t -178.27 149.45 0.53 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.181 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.44 HG21 ' N ' ' A' ' 107' ' ' ALA . 5.0 mt -82.41 137.79 20.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.078 179.843 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . 0.44 ' N ' HG21 ' A' ' 106' ' ' ILE . . . -158.18 150.47 22.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.133 179.99 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . 0.482 ' O ' ' CB ' ' A' ' 109' ' ' ARG . 8.7 t30 179.49 59.29 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.918 -179.998 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . 0.482 ' CB ' ' O ' ' A' ' 108' ' ' ASN . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.244 -0.884 . . . . 0.0 110.887 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.463 ' O ' HG13 ' A' ' 30' ' ' ILE . 35.1 Cg_exo . . . . . 0 C--O 1.231 0.164 0 CA-C-O 120.894 0.289 . . . . 0.0 112.33 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . 0.469 ' HA2' HG13 ' A' ' 30' ' ' ILE . . . -70.73 -148.78 0.5 Allowed Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.443 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 81.0 m -134.83 93.76 3.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.912 0.387 . . . . 0.0 110.956 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -47.91 147.89 1.85 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.023 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.43 ' O ' ' CG ' ' A' ' 24' ' ' ASN . 14.2 t0 -178.3 131.85 0.14 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.767 179.977 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.43 ' CG ' ' O ' ' A' ' 23' ' ' ASP . 10.1 p30 51.04 22.92 1.34 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.989 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 88.64 -10.18 73.1 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.508 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.402 ' HB3' ' CZ ' ' A' ' 28' ' ' TYR . 0.1 OUTLIER -92.56 131.29 37.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.795 0.331 . . . . 0.0 110.835 179.963 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 14.7 t-160 -113.87 91.08 3.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.145 -179.704 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.454 ' O ' ' HA3' ' A' ' 20' ' ' GLY . 0.5 OUTLIER -79.76 176.9 9.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.802 179.837 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.529 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 0.0 OUTLIER -91.11 148.11 22.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.953 -179.946 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.469 HG13 ' HA2' ' A' ' 20' ' ' GLY . 3.7 mp -48.07 148.76 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.298 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 11.6 m-20 62.79 15.54 8.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.197 179.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.529 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 15.1 tt0 -98.14 150.36 21.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.804 0.335 . . . . 0.0 110.727 179.864 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.524 ' HG2' ' CG2' ' A' ' 46' ' ' THR . 8.8 mt-30 -110.21 156.17 21.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.086 -179.737 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . 0.584 ' CH2' ' O ' ' A' ' 46' ' ' THR . 48.6 p90 -162.56 -170.9 2.55 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.76 179.603 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -112.39 132.82 54.81 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.41 -179.581 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.521 ' O ' ' N ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -134.17 -174.1 3.45 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.22 179.548 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.7 t -145.53 134.93 23.1 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.963 0.411 . . . . 0.0 111.312 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.448 ' CB ' HD23 ' A' ' 43' ' ' LEU . 1.6 t80 -128.95 122.75 30.85 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.597 179.696 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.443 ' CB ' ' O ' ' A' ' 38' ' ' TYR . 1.5 tp 78.85 8.71 1.96 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.663 -179.595 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 89.12 41.59 5.82 Favored Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.995 -0.622 . . . . 0.0 112.754 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.43 ' O ' ' C ' ' A' ' 42' ' ' ALA . 65.2 m-80 -152.14 136.85 17.01 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.681 0.277 . . . . 0.0 111.069 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.455 ' O ' HD13 ' A' ' 43' ' ' LEU . . . -37.08 152.25 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.643 179.659 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.521 ' N ' ' O ' ' A' ' 36' ' ' ARG . 2.6 tp -167.15 156.56 10.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.02 0.438 . . . . 0.0 111.535 -179.537 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.493 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 15.2 t -110.09 155.54 11.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.693 178.927 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.574 ' SG ' ' CD1' ' A' ' 54' ' ' PHE . 0.1 OUTLIER -161.22 174.02 14.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.112 0.482 . . . . 0.0 111.6 -179.502 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.584 ' O ' ' CH2' ' A' ' 34' ' ' TRP . 0.2 OUTLIER -138.79 -167.58 2.24 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.746 179.878 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.492 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 46.4 t -134.82 140.45 45.86 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.94 0.4 . . . . 0.0 111.019 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -110.54 -36.94 5.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.776 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.478 ' O ' ' N ' ' A' ' 51' ' ' SER . . . 127.18 163.66 11.49 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.406 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . 0.42 ' C ' ' O ' ' A' ' 49' ' ' GLY . . . 36.1 29.86 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.693 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' SER . . . . . 0.478 ' N ' ' O ' ' A' ' 49' ' ' GLY . 0.1 OUTLIER 49.65 35.24 8.35 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.86 0.362 . . . . 0.0 111.006 179.935 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.467 ' HG3' ' O ' ' A' ' 49' ' ' GLY . 9.7 mtp85 -58.83 -51.91 67.97 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.723 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 156.83 89.75 0.07 OUTLIER Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.613 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.574 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 1.8 p90 -58.17 -172.03 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.836 0.35 . . . . 0.0 110.813 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -136.13 114.09 11.29 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.76 179.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.493 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 13.3 m -94.61 -178.64 4.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.01 -179.855 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . 0.426 ' O ' ' CD1' ' A' ' 43' ' ' LEU . 0.1 OUTLIER -171.95 -92.29 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.023 -179.996 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.464 ' HA ' ' HA ' ' A' ' 43' ' ' LEU . 0.2 OUTLIER 175.81 -177.16 0.12 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.914 -179.91 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 1.3 mmmt . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.915 -179.935 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.232 0.174 0 CA-C-O 120.799 0.333 . . . . 0.0 110.635 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.449 ' O ' HG22 ' A' ' 65' ' ' THR . 17.4 tt0 -177.29 39.54 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.889 179.969 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.449 HG22 ' O ' ' A' ' 64' ' ' GLU . 7.1 p -146.7 -166.16 2.42 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.129 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.453 ' O ' ' HB3' ' A' ' 67' ' ' PHE . 0.0 OUTLIER -157.02 -63.66 0.1 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.888 -179.934 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.458 ' CE1' ' HA ' ' A' ' 69' ' ' LYS . 24.3 t80 79.76 92.25 0.05 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.806 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . 0.452 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 0.6 OUTLIER -88.69 44.4 1.2 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.988 -179.96 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.581 ' HG3' ' CD1' ' A' ' 70' ' ' TYR . 2.2 ptmt 36.16 -144.52 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.728 179.836 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . 0.581 ' CD1' ' HG3' ' A' ' 69' ' ' LYS . 9.4 m-30 79.95 -50.33 0.37 Allowed 'General case' 0 C--O 1.231 0.129 0 CA-C-O 120.722 0.296 . . . . 0.0 110.854 -179.687 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.478 HG22 ' N ' ' A' ' 72' ' ' GLY . 5.3 t -171.37 -35.88 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.26 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . 0.478 ' N ' HG22 ' A' ' 71' ' ' THR . . . 141.41 55.88 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.554 -179.861 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 24.0 m-80 -104.44 49.53 0.81 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.738 0.304 . . . . 0.0 110.963 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' THR . . . . . 0.412 ' O ' HG22 ' A' ' 74' ' ' THR . 4.5 t -43.0 128.19 4.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.128 179.96 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.489 ' CE2' ' CE2' ' A' ' 81' ' ' TYR . 52.3 m-85 -108.06 -179.93 4.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.941 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 2.8 tpp180 -112.65 132.15 55.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.829 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.522 HG22 ' CB ' ' A' ' 97' ' ' ALA . 11.7 p -54.18 -19.5 3.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.091 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -111.7 34.96 4.96 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.529 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -154.1 125.62 7.53 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.888 0.375 . . . . 0.0 111.022 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 58.8 p -78.5 168.24 20.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.04 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . 0.506 ' CZ ' ' CB ' ' A' ' 92' ' ' CYS . 22.3 p90 -166.38 167.47 15.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.859 -179.891 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.413 ' HB3' ' HA ' ' A' ' 91' ' ' ASP . 0.0 OUTLIER -138.99 132.45 30.25 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.849 179.89 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.422 ' HD2' ' OH ' ' A' ' 75' ' ' TYR . 3.3 mtp180 -136.2 140.91 34.26 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.023 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_endo -77.78 124.32 6.81 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.853 2.369 . . . . 0.0 112.327 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.535 ' O ' ' CB ' ' A' ' 86' ' ' ASP . 12.4 tppt? -129.27 108.37 10.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.879 179.845 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.535 ' CB ' ' O ' ' A' ' 85' ' ' LYS . 6.7 t0 87.86 -35.18 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.03 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' SER . . . . . 0.5 ' CB ' ' O ' ' A' ' 86' ' ' ASP . 0.4 OUTLIER 159.02 -23.33 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.771 -179.999 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -98.32 154.84 17.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.875 -179.889 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 14.0 mt -106.05 135.0 46.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.072 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' TRP . . . . . 0.611 ' N ' ' CD1' ' A' ' 90' ' ' TRP . 0.1 OUTLIER -130.23 130.78 45.07 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.832 179.955 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.413 ' HA ' ' HB3' ' A' ' 82' ' ' GLU . 60.2 m-20 -72.58 62.41 0.55 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.942 -179.878 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . 0.506 ' CB ' ' CZ ' ' A' ' 81' ' ' TYR . 57.1 m -48.91 145.23 4.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.0 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' THR . . . . . 0.445 ' O ' ' N ' ' A' ' 95' ' ' ILE . 10.6 m -132.15 125.42 31.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.038 179.843 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 45.3 t -61.59 77.87 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.854 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.445 ' N ' ' O ' ' A' ' 93' ' ' THR . 1.5 mt -90.75 84.55 2.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.307 -179.84 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 157.1 -23.4 0.46 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.455 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.522 ' CB ' HG22 ' A' ' 77' ' ' VAL . . . 59.56 44.09 15.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.855 0.36 . . . . 0.0 111.042 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 159.63 -55.69 0.34 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.528 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 178.99 44.65 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.809 0.337 . . . . 0.0 110.973 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -74.61 -64.81 2.28 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.489 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.512 ' O ' ' N ' ' A' ' 103' ' ' SER . 1.5 ptt180 -177.7 62.79 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.725 0.298 . . . . 0.0 110.94 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . 0.411 ' C ' ' O ' ' A' ' 101' ' ' ARG . 13.2 mt -36.15 91.94 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.135 -179.93 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' SER . . . . . 0.512 ' N ' ' O ' ' A' ' 101' ' ' ARG . 0.3 OUTLIER -74.23 145.98 43.67 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.815 179.986 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 29.7 m -146.27 137.78 24.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.828 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 3.4 t -143.1 127.19 17.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.15 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.57 HG13 ' CE3' ' A' ' 90' ' ' TRP . 3.0 mt -41.6 126.01 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.033 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -107.49 105.78 15.85 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.07 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . 0.503 ' O ' ' CB ' ' A' ' 109' ' ' ARG . 4.6 m-20 -69.02 82.1 0.31 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.904 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . 0.503 ' CB ' ' O ' ' A' ' 108' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.195 -0.907 . . . . 0.0 110.9 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo . . . . . 0 N--CA 1.462 -0.356 0 CA-C-O 120.787 0.245 . . . . 0.0 112.419 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . 0.446 ' HA2' HG13 ' A' ' 30' ' ' ILE . . . 126.86 -173.88 18.26 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.682 -0.771 . . . . 0.0 112.611 179.934 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 3.3 m -145.91 91.76 2.12 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.852 0.358 . . . . 0.0 110.779 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -57.3 129.59 42.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.003 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.455 ' OD2' ' CE2' ' A' ' 54' ' ' PHE . 0.4 OUTLIER -161.65 135.17 6.47 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.82 179.98 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.424 ' O ' ' CG ' ' A' ' 24' ' ' ASN . 36.3 t30 62.28 38.96 12.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.865 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 60.47 17.45 47.72 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.622 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.572 ' HB3' ' CE1' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -133.05 137.82 46.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.848 0.356 . . . . 0.0 110.949 -179.985 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 51.9 t-80 -105.38 96.87 6.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.834 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.572 ' CE1' ' HB3' ' A' ' 26' ' ' LYS . 10.4 m-30 -79.68 170.54 16.38 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.804 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.464 ' O ' ' HB2' ' A' ' 32' ' ' GLN . 4.8 tm0? -89.93 130.98 36.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.504 179.742 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.472 ' HA ' ' SG ' ' A' ' 47' ' ' CYS . 4.3 mp -33.99 148.22 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.924 0.393 . . . . 0.0 111.383 -179.845 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.439 ' HB2' ' O ' ' A' ' 30' ' ' ILE . 34.1 m-20 76.47 4.53 3.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.847 -179.672 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.464 ' HB2' ' O ' ' A' ' 29' ' ' GLN . 7.2 tp60 -91.08 134.38 34.56 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.582 179.712 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.449 ' O ' ' NE2' ' A' ' 32' ' ' GLN . 20.9 mt-30 -103.17 148.31 25.93 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.034 -179.792 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . 0.534 ' CZ2' ' HB3' ' A' ' 45' ' ' CYS . 35.5 p90 -157.28 179.01 9.67 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.672 179.886 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -118.54 122.16 42.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.904 0.383 . . . . 0.0 111.377 -179.551 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.528 ' O ' ' CD2' ' A' ' 43' ' ' LEU . 3.8 ttt85 -114.59 141.53 47.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.528 179.592 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.532 ' CG2' ' N ' ' A' ' 38' ' ' TYR . 1.4 m -102.03 162.35 12.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.037 -179.782 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.532 ' N ' ' CG2' ' A' ' 37' ' ' THR . 13.0 t80 177.02 115.26 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.754 179.947 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.513 ' O ' ' ND2' ' A' ' 41' ' ' ASN . 0.8 OUTLIER 74.66 34.43 0.74 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.831 -179.864 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 68.04 30.55 74.08 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.43 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.513 ' ND2' ' O ' ' A' ' 39' ' ' LEU . 22.6 m-80 -134.12 146.0 49.84 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 120.837 0.351 . . . . 0.0 110.962 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.426 ' C ' HD13 ' A' ' 43' ' ' LEU . . . -100.08 112.34 24.63 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.999 179.896 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.596 ' N ' ' CD1' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -112.81 143.41 44.1 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.013 -179.989 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.486 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.7 t -93.7 126.9 46.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.348 179.261 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.57 ' SG ' ' CE1' ' A' ' 54' ' ' PHE . 6.2 m -105.64 166.94 10.1 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.698 -179.207 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.449 ' O ' ' HA ' ' A' ' 54' ' ' PHE . 26.0 m -150.49 124.47 9.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.679 179.642 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.472 ' SG ' ' HA ' ' A' ' 30' ' ' ILE . 15.1 t -79.79 130.39 35.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.032 -179.712 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -111.97 -25.59 9.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.93 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 94.58 -179.14 37.13 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.451 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 42.59 -129.69 5.0 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.59 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -89.33 -27.97 20.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.825 0.345 . . . . 0.0 110.979 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -49.69 -29.52 7.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.964 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 50.11 -125.37 19.95 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.629 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.57 ' CE1' ' SG ' ' A' ' 45' ' ' CYS . 1.1 p90 -132.85 160.2 37.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.829 0.347 . . . . 0.0 110.902 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -138.23 85.47 2.1 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.713 179.79 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.486 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.1 OUTLIER -63.3 158.9 19.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.045 -179.741 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -137.65 -70.13 0.44 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.844 179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.469 ' HA ' ' HA ' ' A' ' 43' ' ' LEU . 85.0 p -172.59 176.86 3.12 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.822 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 46.3 tptt . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.78 180.0 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.422 ' O ' ' N ' ' A' ' 65' ' ' THR . 1.3 tt0 . . . . . 0 N--CA 1.456 -0.174 0 CA-C-O 120.897 0.38 . . . . 0.0 110.43 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 87.9 mt-10 -62.33 78.59 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.806 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.422 ' N ' ' O ' ' A' ' 63' ' ' GLU . 7.3 p -142.45 150.67 40.88 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.189 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.411 ' SG ' ' HB2' ' A' ' 75' ' ' TYR . 0.3 OUTLIER -152.02 178.73 9.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.613 179.924 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 12.0 t80 -168.73 100.94 0.4 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.966 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . 0.477 ' O ' ' O ' ' A' ' 69' ' ' LYS . 28.2 t0 -101.97 32.52 3.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.855 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.511 ' HD2' ' CE1' ' A' ' 70' ' ' TYR . 0.0 OUTLIER 39.07 -165.76 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.153 179.808 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . 0.511 ' CE1' ' HD2' ' A' ' 69' ' ' LYS . 12.4 m-85 74.56 -54.62 0.67 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.131 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -127.33 -4.25 6.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.295 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 51.69 26.13 16.22 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.361 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . 0.541 ' O ' ' CE1' ' A' ' 75' ' ' TYR . 35.7 t-20 -77.04 90.88 3.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.739 0.305 . . . . 0.0 110.965 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 56.2 m -49.52 119.41 3.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.036 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.541 ' CE1' ' O ' ' A' ' 73' ' ' ASN . 9.9 m-85 -102.95 172.8 6.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.818 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -111.92 133.55 54.04 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.781 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.448 ' HA ' ' HB3' ' A' ' 94' ' ' CYS . 53.1 t -49.4 -37.15 10.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.06 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -85.14 41.67 3.08 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.498 179.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -164.32 178.32 7.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.83 0.348 . . . . 0.0 110.993 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.465 HG23 ' CG2' ' A' ' 93' ' ' THR . 19.1 p -132.7 151.28 52.01 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.059 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . 0.452 ' OH ' HG23 ' A' ' 102' ' ' ILE . 24.0 p90 -136.72 115.19 11.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.876 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -82.18 112.99 19.7 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.798 179.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.2 106.0 53.47 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.921 -179.924 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.45 ' HB3' HG12 ' A' ' 89' ' ' ILE . 71.5 Cg_endo -74.66 141.27 27.51 Favored 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.816 2.344 . . . . 0.0 112.303 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.462 ' O ' ' CB ' ' A' ' 86' ' ' ASP . 12.3 tptp -151.51 99.15 2.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.948 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.462 ' CB ' ' O ' ' A' ' 85' ' ' LYS . 0.3 OUTLIER 80.31 -167.54 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.907 -179.969 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.65 55.97 2.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.87 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 2.9 ptp -145.52 -60.97 0.34 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.881 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.45 HG12 ' HB3' ' A' ' 84' ' ' PRO . 60.9 mt 62.45 130.47 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.179 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' TRP . . . . . 0.614 ' N ' ' CD1' ' A' ' 90' ' ' TRP . 0.0 OUTLIER -137.65 172.76 12.48 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.884 179.971 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -110.24 82.68 1.63 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.902 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 23.2 m -68.77 135.05 50.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.981 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' THR . . . . . 0.465 ' CG2' HG23 ' A' ' 80' ' ' THR . 0.8 OUTLIER -115.91 174.76 5.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.924 179.782 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . 0.448 ' HB3' ' HA ' ' A' ' 77' ' ' VAL . 36.7 t -108.99 40.27 1.85 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.87 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.461 HG23 HD13 ' A' ' 95' ' ' ILE . 2.0 mt -56.76 110.68 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.38 -179.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 140.74 135.86 3.25 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.497 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -60.97 -14.77 24.98 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.838 0.352 . . . . 0.0 111.113 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . 0.422 ' O ' ' HB3' ' A' ' 99' ' ' ARG . . . -144.08 24.98 2.07 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.535 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.422 ' HB3' ' O ' ' A' ' 98' ' ' GLY . 4.5 tmm_? 64.8 132.22 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.843 0.354 . . . . 0.0 110.928 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 165.76 -36.04 0.26 Allowed Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.42 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 3.1 mtm-85 -102.52 43.12 1.09 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.832 0.348 . . . . 0.0 110.846 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . 0.452 HG23 ' OH ' ' A' ' 81' ' ' TYR . 5.2 mp -54.41 95.47 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.142 -179.821 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.72 124.66 28.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.649 179.774 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 4.1 m -129.04 121.96 28.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.994 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 1.1 t -135.83 139.88 43.79 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.985 179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.532 HG13 ' CE3' ' A' ' 90' ' ' TRP . 2.6 mt -61.1 143.05 15.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.101 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . 0.507 ' N ' HG21 ' A' ' 106' ' ' ILE . . . 171.6 117.79 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.116 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -163.68 116.47 1.47 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.85 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 18.3 ttp180 . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.267 -0.873 . . . . 0.0 110.9 179.912 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo . . . . . 0 C--O 1.231 0.147 0 CA-C-O 120.845 0.269 . . . . 0.0 112.265 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 114.43 167.6 15.89 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.648 -0.786 . . . . 0.0 112.536 179.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 8.9 p -152.59 123.34 7.38 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.793 0.33 . . . . 0.0 110.847 -180.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 7.0 t80 -92.08 95.4 9.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.924 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.446 ' OD2' ' CE1' ' A' ' 54' ' ' PHE . 1.2 m-20 -117.0 139.61 50.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.821 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.464 ' OD1' ' O ' ' A' ' 24' ' ' ASN . 27.5 t-20 50.09 45.59 25.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.709 -179.959 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.12 16.86 28.09 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.363 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.95 152.56 47.74 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.818 0.342 . . . . 0.0 110.936 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 20.9 t-80 -116.85 97.97 6.25 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.136 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 15.6 m-85 -79.87 -178.72 6.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.854 179.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.495 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 2.1 tt0 -93.64 120.65 34.18 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.588 179.709 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.465 ' HA ' ' SG ' ' A' ' 47' ' ' CYS . 4.4 mp -33.86 138.91 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.353 -179.825 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.488 ' N ' ' O ' ' A' ' 47' ' ' CYS . 34.3 m-20 76.97 5.35 3.31 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.762 -179.686 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.495 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 11.8 tt0 -86.61 154.19 21.22 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.774 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.524 ' CG ' HG23 ' A' ' 46' ' ' THR . 36.5 mt-30 -122.64 124.84 44.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.15 -179.683 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . 0.528 ' CH2' ' O ' ' A' ' 46' ' ' THR . 22.9 p90 -131.0 175.63 8.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.791 179.742 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 33.6 tp10 -100.18 126.64 46.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.863 0.363 . . . . 0.0 111.313 -179.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.451 ' O ' ' O ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -138.25 -161.93 1.24 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.468 179.643 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 2.2 t -143.83 141.46 30.37 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.952 0.406 . . . . 0.0 111.452 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.526 ' CD2' HD12 ' A' ' 39' ' ' LEU . 9.8 t80 -131.17 132.73 44.94 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.461 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.526 HD12 ' CD2' ' A' ' 38' ' ' TYR . 3.4 mp 63.44 16.96 9.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.947 0.404 . . . . 0.0 110.319 -179.53 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 83.41 37.07 12.74 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.938 -0.649 . . . . 0.0 112.563 -179.871 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 64.1 m-80 -146.55 139.7 25.58 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 120.77 0.319 . . . . 0.0 111.075 -179.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -48.04 134.19 14.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.835 179.739 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.504 HD12 ' N ' ' A' ' 57' ' ' GLU . 0.0 OUTLIER -165.36 147.44 7.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.02 0.438 . . . . 0.0 110.954 -179.752 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.457 ' O ' ' HB3' ' A' ' 56' ' ' CYS . 5.1 t -90.11 134.46 29.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.809 179.822 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.467 ' HA ' ' HA ' ' A' ' 56' ' ' CYS . 5.4 m -119.65 123.4 43.77 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.107 -179.706 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.528 ' O ' ' CH2' ' A' ' 34' ' ' TRP . 0.2 OUTLIER -94.77 -174.04 3.17 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.003 179.868 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.528 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 27.8 t -138.69 119.8 14.55 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.85 0.357 . . . . 0.0 110.88 -179.843 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 9.9 m-30 -90.91 -46.32 8.25 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.261 -179.871 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 103.14 166.33 25.81 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.45 -179.737 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 65.31 -116.83 9.23 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.612 179.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 4.9 p -125.11 -6.85 7.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.731 0.301 . . . . 0.0 111.187 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 4.0 mtm180 -56.91 -29.28 62.91 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.897 0.379 . . . . 0.0 110.876 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 64.33 137.2 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.729 179.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.528 ' CB ' ' O ' ' A' ' 46' ' ' THR . 38.5 p90 -59.28 -167.8 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.574 0.226 . . . . 0.0 110.671 179.737 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.524 ' O ' ' CB ' ' A' ' 56' ' ' CYS . 2.3 t30 -147.16 -49.95 0.19 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.821 0.343 . . . . 0.0 111.601 -179.739 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.524 ' CB ' ' O ' ' A' ' 55' ' ' ASN . 5.2 m 85.62 -172.64 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.424 -179.611 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . 0.504 ' N ' HD12 ' A' ' 43' ' ' LEU . 3.9 tt0 -156.78 -89.23 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.858 0.361 . . . . 0.0 111.359 -179.837 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.453 ' HA ' ' HA ' ' A' ' 43' ' ' LEU . 0.3 OUTLIER 170.97 146.44 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.835 -179.701 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.813 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.456 -0.144 0 CA-C-O 120.841 0.353 . . . . 0.0 110.55 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -163.86 139.4 6.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.84 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.503 ' OG1' ' CG2' ' A' ' 74' ' ' THR . 12.6 p -57.95 -176.63 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.273 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 60.1 m -114.46 156.43 24.56 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.944 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 89.8 t80 -112.35 87.6 2.61 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.972 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.95 85.96 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.937 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 4.2 ptmt -41.08 -28.2 0.08 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.869 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 14.6 m-30 -40.02 -72.74 0.06 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.924 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.421 ' HB ' ' OD1' ' A' ' 73' ' ' ASN . 6.3 m -117.78 20.79 13.25 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.099 179.817 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 55.95 54.23 36.74 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.46 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . 0.421 ' OD1' ' HB ' ' A' ' 71' ' ' THR . 0.4 OUTLIER -108.41 -162.9 0.84 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.763 0.316 . . . . 0.0 110.846 179.949 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' THR . . . . . 0.503 ' CG2' ' OG1' ' A' ' 65' ' ' THR . 1.1 m -146.01 133.05 20.3 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.065 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.43 ' O ' ' HB ' ' A' ' 65' ' ' THR . 2.7 m-85 -123.22 128.64 50.29 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.859 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 2.7 mmt180 -45.55 137.5 5.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.849 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.406 ' HA ' ' SG ' ' A' ' 94' ' ' CYS . 12.2 p -82.09 -17.03 11.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.194 -179.912 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -102.04 9.38 56.45 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.446 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -138.52 159.26 42.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.828 0.347 . . . . 0.0 110.896 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.497 ' OG1' ' N ' ' A' ' 81' ' ' TYR . 0.1 OUTLIER -106.59 -173.4 2.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.989 179.943 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . 0.508 ' CZ ' ' HB3' ' A' ' 92' ' ' CYS . 15.2 p90 -164.74 -177.81 4.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.868 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -135.2 110.54 9.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.82 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.61 96.05 9.7 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.904 -179.977 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -69.78 84.37 0.66 Allowed 'Trans proline' 0 C--O 1.231 0.145 0 C-N-CA 122.78 2.32 . . . . 0.0 112.227 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.87 139.37 32.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.91 179.887 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 46.32 -157.89 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.935 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' SER . . . . . 0.442 ' O ' ' HB2' ' A' ' 88' ' ' MET . 0.4 OUTLIER -84.03 62.8 7.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.931 -179.986 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' MET . . . . . 0.442 ' HB2' ' O ' ' A' ' 87' ' ' SER . 1.3 ttt 174.44 149.6 0.08 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.926 -179.944 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.534 ' C ' ' CD1' ' A' ' 90' ' ' TRP . 17.1 mt -110.37 157.79 10.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.124 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' TRP . . . . . 0.575 ' N ' ' CD1' ' A' ' 90' ' ' TRP . 0.1 OUTLIER -146.0 134.08 21.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.948 179.989 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 29.2 t0 -72.41 62.8 0.53 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.774 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . 0.508 ' HB3' ' CZ ' ' A' ' 81' ' ' TYR . 67.9 m -55.49 146.04 21.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.052 -179.87 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' THR . . . . . 0.462 ' O ' ' N ' ' A' ' 95' ' ' ILE . 21.2 m -144.03 141.31 30.04 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.96 179.806 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . 0.406 ' SG ' ' HA ' ' A' ' 77' ' ' VAL . 50.3 t -66.29 60.21 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.975 -179.759 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.517 ' O ' ' N ' ' A' ' 101' ' ' ARG . 2.6 mt -68.77 80.17 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.001 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -114.34 -107.15 2.71 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.462 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . 55.09 79.79 0.14 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.748 0.309 . . . . 0.0 111.085 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 82.65 -55.28 4.99 Favored Glycine 0 N--CA 1.453 -0.207 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.448 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 6.8 mtt180 -179.12 63.23 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.889 0.376 . . . . 0.0 110.965 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . 0.461 ' O ' ' HB3' ' A' ' 101' ' ' ARG . . . -89.28 -28.21 20.73 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.528 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.517 ' N ' ' O ' ' A' ' 95' ' ' ILE . 0.0 OUTLIER 66.8 104.24 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.81 0.338 . . . . 0.0 110.9 179.952 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . 0.433 ' CG2' ' OH ' ' A' ' 81' ' ' TYR . 2.5 mp -36.32 128.36 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.126 179.81 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' SER . . . . . 0.502 ' HB3' ' CD1' ' A' ' 95' ' ' ILE . 29.2 t -110.21 163.08 13.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.077 -179.911 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 82.3 m -154.49 119.9 5.09 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.935 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 22.1 m -133.45 124.7 27.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.167 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.478 ' CD1' ' CZ3' ' A' ' 90' ' ' TRP . 2.4 mp -58.79 87.67 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.116 179.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -108.28 141.95 39.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.197 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -79.74 134.15 36.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.935 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.814 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo . . . . . 0 N--CA 1.463 -0.297 0 CA-C-O 120.733 0.222 . . . . 0.0 112.386 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 176.81 -161.66 29.63 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.515 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.576 ' O ' ' CD2' ' A' ' 27' ' ' HIS . 0.1 OUTLIER -159.15 178.38 10.08 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.779 0.323 . . . . 0.0 110.878 -179.946 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 48.2 t80 -161.89 126.67 3.38 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.945 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -163.83 159.21 20.9 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.931 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 46.19 31.96 1.34 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.914 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 65.83 21.31 69.27 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.56 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.26 152.32 44.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.831 0.348 . . . . 0.0 110.91 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . 0.576 ' CD2' ' O ' ' A' ' 21' ' ' CYS . 6.0 t-160 -117.29 96.47 5.44 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.136 -179.689 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -88.53 -162.45 0.85 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.9 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.524 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 0.5 OUTLIER -124.83 156.7 37.4 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.756 179.868 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.456 ' HA ' ' SG ' ' A' ' 47' ' ' CYS . 3.5 mp -51.99 150.46 1.04 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.37 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.125 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 17.5 m-20 64.87 13.93 8.88 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.776 -179.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.524 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 12.9 tt0 -98.54 145.53 26.71 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.792 -179.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.443 ' CG ' HG21 ' A' ' 46' ' ' THR . 14.1 mt-30 -118.01 143.69 46.19 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.848 -179.78 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . 0.577 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 35.9 p90 -144.13 -172.07 3.69 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.829 179.83 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -116.08 133.14 56.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.928 0.394 . . . . 0.0 111.239 -179.814 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.4 171.24 14.77 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.502 179.72 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -134.69 142.8 46.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.937 0.398 . . . . 0.0 110.787 -179.841 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.489 ' CB ' HD22 ' A' ' 43' ' ' LEU . 0.7 OUTLIER -155.21 120.46 4.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.686 179.671 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.475 ' CB ' ' O ' ' A' ' 38' ' ' TYR . 1.6 tp 80.91 22.62 0.36 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.58 -179.732 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 68.19 37.71 87.11 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.918 -0.658 . . . . 0.0 112.438 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.434 ' O ' ' C ' ' A' ' 42' ' ' ALA . 51.1 m-80 -148.35 133.37 18.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.667 0.27 . . . . 0.0 110.945 179.919 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.451 ' O ' HD13 ' A' ' 43' ' ' LEU . . . -35.69 153.92 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.801 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.489 HD22 ' CB ' ' A' ' 38' ' ' TYR . 3.1 tp -161.52 146.05 13.2 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.144 -179.543 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.48 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 3.9 t -121.61 136.85 57.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.417 179.547 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.577 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 0.7 OUTLIER -116.41 161.39 19.14 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.322 -179.509 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.443 HG21 ' CG ' ' A' ' 33' ' ' GLN . 1.4 m -144.29 127.73 16.93 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.936 179.818 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.499 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 19.4 t -87.28 138.61 31.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.057 -179.868 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.418 ' CE1' ' O ' ' A' ' 46' ' ' THR . 11.6 m-85 -122.4 -33.13 3.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.928 179.953 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.429 ' O ' ' HB2' ' A' ' 52' ' ' ARG . . . 64.75 -165.7 32.82 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.498 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . 0.501 ' O ' ' CB ' ' A' ' 51' ' ' SER . . . 56.65 31.13 60.19 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.523 -179.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' SER . . . . . 0.501 ' CB ' ' O ' ' A' ' 50' ' ' GLY . 0.8 OUTLIER 83.88 -10.01 0.95 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.706 0.289 . . . . 0.0 110.995 -179.978 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.429 ' HB2' ' O ' ' A' ' 49' ' ' GLY . 34.1 mtt85 -67.85 -46.78 70.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.021 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 92.47 -141.33 15.53 Favored Glycine 0 N--CA 1.446 -0.638 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.608 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.568 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 5.8 p90 -143.27 157.0 44.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.844 0.354 . . . . 0.0 110.92 -179.947 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 -131.57 124.89 30.97 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.809 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.48 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.5 OUTLIER -100.5 163.15 12.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.021 -179.963 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . 0.456 ' O ' ' HA ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -175.02 -177.62 1.1 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.937 179.898 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -65.95 178.58 1.07 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.932 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.891 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.417 ' O ' ' HB1' ' A' ' 97' ' ' ALA . 2.7 tt0 . . . . . 0 N--CA 1.446 -0.632 0 CA-C-O 120.811 0.338 . . . . 0.0 111.165 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.424 ' O ' HG23 ' A' ' 65' ' ' THR . 3.1 mt-10 -64.2 120.85 12.9 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.91 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.424 HG23 ' O ' ' A' ' 64' ' ' GLU . 0.2 OUTLIER 175.59 -171.82 0.07 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.116 179.952 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.437 ' O ' HG22 ' A' ' 74' ' ' THR . 4.1 t -178.27 169.17 1.87 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.923 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 49.2 t80 -119.59 -52.95 2.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.959 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 17.6 t70 71.8 84.04 0.13 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.876 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.495 ' O ' ' CB ' ' A' ' 70' ' ' TYR . 0.0 OUTLIER -57.53 -170.61 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.903 179.914 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . 0.495 ' CB ' ' O ' ' A' ' 69' ' ' LYS . 7.3 m-85 84.4 -4.2 1.03 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.05 -179.882 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.484 ' CG2' ' C ' ' A' ' 70' ' ' TYR . 0.0 OUTLIER 165.26 -26.22 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.2 -179.95 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 97.64 76.18 1.27 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.478 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -122.09 80.16 1.67 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.749 0.309 . . . . 0.0 110.96 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' THR . . . . . 0.437 HG22 ' O ' ' A' ' 66' ' ' CYS . 94.4 m -50.58 110.35 0.4 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.977 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.45 ' HB2' ' SG ' ' A' ' 94' ' ' CYS . 18.1 m-85 -108.68 164.08 12.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.646 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 4.2 mtt180 -78.83 117.37 19.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.952 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.458 ' HA ' ' O ' ' A' ' 94' ' ' CYS . 7.6 p -47.83 -22.69 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.191 -179.922 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -95.06 11.54 69.29 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.517 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -144.79 151.12 38.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.814 0.34 . . . . 0.0 110.962 179.961 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.461 HG22 ' CG2' ' A' ' 93' ' ' THR . 0.6 OUTLIER -96.72 -155.41 0.48 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.14 -179.921 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . 0.532 ' O ' ' CB ' ' A' ' 82' ' ' GLU . 9.6 p90 -172.02 -35.13 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.069 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.532 ' CB ' ' O ' ' A' ' 81' ' ' TYR . 0.7 OUTLIER 87.29 157.6 0.07 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.897 179.9 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 2.7 mtt-85 178.44 119.01 0.19 Allowed Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.849 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.73 167.62 25.17 Favored 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.748 2.299 . . . . 0.0 112.477 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.436 ' O ' ' N ' ' A' ' 87' ' ' SER . 0.0 OUTLIER -171.8 150.46 2.65 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.649 179.976 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 56.8 -85.04 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.886 -179.857 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' SER . . . . . 0.436 ' N ' ' O ' ' A' ' 85' ' ' LYS . 0.4 OUTLIER -159.71 23.18 0.18 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.952 179.848 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' MET . . . . . 0.409 ' O ' ' CD1' ' A' ' 90' ' ' TRP . 0.0 OUTLIER -148.85 146.1 27.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.971 -179.854 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 10.4 mt -90.83 134.44 29.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.986 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' TRP . . . . . 0.543 ' N ' ' CD1' ' A' ' 90' ' ' TRP . 1.0 OUTLIER -125.44 144.55 50.47 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.038 -179.901 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 57.9 m-20 -80.04 67.68 5.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.658 179.748 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 23.1 m -55.09 124.62 17.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.035 -179.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' THR . . . . . 0.461 ' CG2' HG22 ' A' ' 80' ' ' THR . 2.0 m -117.87 113.96 22.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.977 179.819 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . 0.458 ' O ' ' HA ' ' A' ' 77' ' ' VAL . 0.0 OUTLIER -54.41 87.62 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.878 -179.81 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.446 HG13 ' O ' ' A' ' 93' ' ' THR . 2.3 mt -117.2 95.52 3.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.196 -179.925 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.401 ' HA3' ' HA2' ' A' ' 100' ' ' GLY . . . -145.98 -94.39 0.16 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.616 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.417 ' HB1' ' O ' ' A' ' 63' ' ' GLU . . . 62.68 41.18 9.47 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.846 0.355 . . . . 0.0 111.06 -179.867 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 139.21 -27.32 2.65 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.554 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.61 -31.71 3.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.841 0.353 . . . . 0.0 110.912 -179.986 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . 0.401 ' HA2' ' HA3' ' A' ' 96' ' ' GLY . . . 60.36 50.71 64.65 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.548 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 6.0 ptp180 -99.18 54.83 0.98 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.787 0.327 . . . . 0.0 110.928 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . 0.413 ' HA ' HD13 ' A' ' 102' ' ' ILE . 5.4 mm -37.3 126.71 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.244 -179.986 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 5.9 t -99.14 131.06 45.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.888 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 24.3 m -135.4 117.45 15.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.031 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 7.3 t -130.86 161.25 32.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.123 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.471 ' CD1' ' CZ3' ' A' ' 90' ' ' TRP . 3.2 mp -82.89 121.21 35.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.091 179.911 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -49.68 140.73 10.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.149 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 65.0 t-20 -88.76 -34.85 16.97 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.869 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . 0.461 ' HG3' ' OXT' ' A' ' 109' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.947 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo . . . . . 0 C--O 1.232 0.2 0 CA-C-O 120.862 0.276 . . . . 0.0 112.3 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 96.66 -156.51 21.08 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.588 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 59.7 m -147.99 97.39 2.79 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.857 0.361 . . . . 0.0 110.847 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -64.97 150.03 48.72 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.826 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.466 ' OD1' ' O ' ' A' ' 26' ' ' LYS . 4.7 p-10 -133.86 -159.99 1.01 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.14 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.421 ' C ' ' O ' ' A' ' 23' ' ' ASP . 1.5 m-20 -34.45 -42.99 0.15 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.171 -179.816 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -173.15 32.11 0.11 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.598 -0.81 . . . . 0.0 112.611 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.575 ' HB3' ' CZ ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -139.93 134.92 32.26 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.815 0.34 . . . . 0.0 110.843 179.964 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 5.8 t-160 -114.21 86.77 2.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.892 -179.67 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.575 ' CZ ' ' HB3' ' A' ' 26' ' ' LYS . 1.6 m-85 -79.62 -168.96 1.74 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.0 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -105.92 165.53 11.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.792 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.453 ' HA ' ' SG ' ' A' ' 47' ' ' CYS . 3.1 mp -58.68 150.35 5.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.473 -179.772 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 67.5 m-80 61.04 13.34 4.56 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.118 179.785 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.405 ' O ' ' CZ3' ' A' ' 34' ' ' TRP . 12.4 tt0 -91.3 150.0 21.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.679 179.813 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 11.8 mt-30 -114.41 145.02 42.37 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.137 -179.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . 0.567 ' CZ2' ' HB3' ' A' ' 45' ' ' CYS . 44.1 p90 -151.59 175.71 12.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.677 179.656 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -111.24 119.8 40.12 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.957 0.408 . . . . 0.0 111.455 -179.563 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.474 ' N ' ' O ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -110.7 -179.84 3.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.369 179.466 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.459 ' CG2' ' N ' ' A' ' 38' ' ' TYR . 1.0 OUTLIER -135.73 159.78 40.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.992 0.425 . . . . 0.0 110.975 -179.669 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.466 ' HB3' HD23 ' A' ' 43' ' ' LEU . 2.3 t80 -178.42 137.06 0.16 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.54 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 59.04 27.55 16.52 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.613 -179.746 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 67.37 49.82 48.88 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.889 -0.672 . . . . 0.0 112.666 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 68.1 m-80 -152.52 167.14 29.79 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.818 0.342 . . . . 0.0 111.016 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.431 ' O ' HD13 ' A' ' 43' ' ' LEU . . . -86.54 131.46 34.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.75 179.693 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.474 ' O ' ' N ' ' A' ' 36' ' ' ARG . 8.5 mp -127.85 155.45 44.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.319 -179.658 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.471 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 1.9 t -120.58 121.64 65.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.426 179.466 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.567 ' HB3' ' CZ2' ' A' ' 34' ' ' TRP . 1.3 m -106.99 163.29 13.1 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.281 -179.516 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.437 ' O ' ' CE1' ' A' ' 48' ' ' TYR . 2.9 m -149.25 117.52 6.44 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.832 179.782 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.453 ' SG ' ' HA ' ' A' ' 30' ' ' ILE . 21.1 t -73.97 134.49 43.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.072 -179.811 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.522 ' CB ' ' HB3' ' A' ' 52' ' ' ARG . 6.8 m-85 -107.24 -29.7 9.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.863 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.45 ' HA3' HG23 ' A' ' 30' ' ' ILE . . . 100.27 168.0 29.07 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.451 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 48.99 -123.27 10.6 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.38 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -105.15 -4.53 21.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.764 0.316 . . . . 0.0 110.998 179.961 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.522 ' HB3' ' CB ' ' A' ' 48' ' ' TYR . 2.2 mtt85 -47.9 -28.16 2.51 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.905 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 60.13 146.7 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.592 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.564 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 22.9 p90 -74.96 177.7 6.13 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.732 0.301 . . . . 0.0 110.941 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -154.85 118.67 4.6 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.958 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.471 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.8 OUTLIER -103.08 150.74 23.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.874 179.942 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . 0.437 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 0.3 OUTLIER -136.01 -86.08 0.35 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.906 -179.958 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.416 ' HA ' ' HA ' ' A' ' 43' ' ' LEU . 5.2 p -170.01 -166.05 0.53 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.96 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.417 ' C ' ' HD2' ' A' ' 59' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.878 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 . . . . . 0 N--CA 1.455 -0.176 0 CA-C-O 120.794 0.331 . . . . 0.0 110.505 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 54.07 58.36 5.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.829 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.495 ' OG1' ' N ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -160.81 -176.44 5.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.007 -179.998 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.495 ' N ' ' OG1' ' A' ' 65' ' ' THR . 0.6 OUTLIER -171.72 175.8 3.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.924 179.913 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.465 ' CE1' ' HA ' ' A' ' 69' ' ' LYS . 20.0 t80 -165.21 110.13 0.9 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.833 -179.961 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . 0.559 ' O ' ' CD2' ' A' ' 70' ' ' TYR . 44.4 t0 -108.45 38.5 2.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.883 -179.947 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.566 ' HG3' ' CD1' ' A' ' 70' ' ' TYR . 4.3 ptmt 34.22 -154.13 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.078 179.988 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . 0.566 ' CD1' ' HG3' ' A' ' 69' ' ' LYS . 15.5 m-85 75.29 -54.22 0.65 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.949 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -138.47 -62.43 0.57 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.244 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 132.53 44.9 0.14 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.572 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -88.95 74.06 8.24 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.795 0.331 . . . . 0.0 111.011 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 33.7 m -45.87 107.88 0.11 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.927 0.394 . . . . 0.0 111.029 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 -85.47 -157.98 0.35 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.884 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . 0.428 ' O ' ' N ' ' A' ' 79' ' ' ASP . 16.2 mtm180 -143.53 135.62 26.77 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.779 179.857 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 52.9 t -43.9 -28.06 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.055 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -109.53 31.03 7.91 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.424 179.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . 0.428 ' N ' ' O ' ' A' ' 76' ' ' ARG . 0.6 OUTLIER -128.47 106.21 8.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.845 0.355 . . . . 0.0 110.829 179.998 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -85.94 118.96 25.74 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.144 -179.974 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . 0.472 ' CZ ' ' HB3' ' A' ' 92' ' ' CYS . 30.1 p90 -120.06 173.87 6.83 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.753 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.436 ' HA ' ' O ' ' A' ' 90' ' ' TRP . 19.4 pt-20 -140.13 155.92 46.77 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.754 179.912 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.422 ' CZ ' ' HE2' ' A' ' 85' ' ' LYS . 0.0 OUTLIER -136.42 119.11 11.93 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.86 -179.929 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.66 95.09 0.62 Allowed 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.622 2.214 . . . . 0.0 112.242 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.422 ' HE2' ' CZ ' ' A' ' 83' ' ' ARG . 0.4 OUTLIER -146.81 163.76 34.99 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.905 -179.952 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 7.4 t0 56.21 49.51 15.23 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.832 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 9.3 m 43.54 31.17 0.4 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.923 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -159.18 175.56 13.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.892 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.457 ' O ' ' HA ' ' A' ' 106' ' ' ILE . 1.6 mp -126.27 134.17 67.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.158 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' TRP . . . . . 0.618 ' N ' ' CD1' ' A' ' 90' ' ' TRP . 0.0 OUTLIER -130.08 124.93 33.96 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.837 179.956 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.408 ' C ' ' O ' ' A' ' 81' ' ' TYR . 0.3 OUTLIER -78.93 71.14 5.37 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.993 -179.89 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . 0.472 ' HB3' ' CZ ' ' A' ' 81' ' ' TYR . 0.5 OUTLIER -45.97 136.42 6.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.895 179.808 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 7.2 m -115.34 122.21 45.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.164 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . 0.452 ' SG ' ' O ' ' A' ' 96' ' ' GLY . 28.5 t -67.62 69.84 0.11 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.718 179.951 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -70.3 -7.88 9.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.408 -179.753 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.459 ' HA3' ' HA3' ' A' ' 100' ' ' GLY . . . -132.15 -165.6 11.35 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.55 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.417 ' HA ' ' O ' ' A' ' 65' ' ' THR . . . -140.3 -41.29 0.42 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.919 0.39 . . . . 0.0 110.927 179.912 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -152.88 17.42 0.73 Allowed Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.322 179.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 170.8 36.97 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.784 0.325 . . . . 0.0 110.957 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . 0.459 ' HA3' ' HA3' ' A' ' 96' ' ' GLY . . . -97.8 -97.18 1.98 Allowed Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.563 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.496 ' O ' ' CG ' ' A' ' 101' ' ' ARG . 0.0 OUTLIER 170.55 75.17 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.792 0.33 . . . . 0.0 110.921 179.924 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . 0.409 HG23 ' OH ' ' A' ' 81' ' ' TYR . 18.8 mt -58.14 79.55 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.085 179.903 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' SER . . . . . 0.481 ' N ' ' O ' ' A' ' 101' ' ' ARG . 9.6 t -58.65 167.82 1.38 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.033 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . 0.403 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 0.0 OUTLIER -146.8 104.95 3.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.774 179.937 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 2.8 t -118.55 135.31 54.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.117 -179.896 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.577 HD12 ' CZ3' ' A' ' 90' ' ' TRP . 2.4 mp -60.2 142.3 15.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.914 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . 0.484 ' N ' HG23 ' A' ' 106' ' ' ILE . . . -132.95 107.31 8.21 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.052 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . 0.417 ' O ' ' C ' ' A' ' 109' ' ' ARG . 32.0 t-20 -112.13 129.81 56.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.998 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . 0.417 ' C ' ' O ' ' A' ' 108' ' ' ASN . 1.0 OUTLIER . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.155 -0.926 . . . . 0.0 110.852 179.959 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo . . . . . 0 N--CA 1.464 -0.253 0 CA-C-O 120.841 0.267 . . . . 0.0 112.418 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 126.89 171.88 13.17 Favored Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.762 -0.733 . . . . 0.0 112.512 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 50.6 m -112.19 85.66 2.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.781 0.325 . . . . 0.0 110.793 -179.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -74.78 124.05 26.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.0 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.425 ' O ' ' CG ' ' A' ' 24' ' ' ASN . 0.3 OUTLIER -167.91 147.6 4.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.889 179.897 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.425 ' CG ' ' O ' ' A' ' 23' ' ' ASP . 8.0 p-10 46.02 53.41 9.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.934 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 53.92 20.27 13.22 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.541 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.57 ' HB3' ' CZ ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -125.83 133.74 51.88 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.807 0.337 . . . . 0.0 111.004 -179.996 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 4.0 t-160 -117.97 84.18 2.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.956 -179.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.57 ' CZ ' ' HB3' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -79.91 167.88 19.95 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.79 179.906 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.462 ' O ' ' HB2' ' A' ' 32' ' ' GLN . 8.5 mt-30 -93.12 170.7 9.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.786 179.808 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.526 ' CG2' ' O ' ' A' ' 48' ' ' TYR . 3.0 mp -65.49 153.74 8.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.338 -179.909 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 84.6 m-20 55.01 17.69 1.97 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.089 179.8 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.462 ' HB2' ' O ' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -97.1 139.26 33.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.816 179.809 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 11.7 mt-30 -107.01 148.66 28.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.872 -179.801 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . 0.534 ' CE2' ' CE1' ' A' ' 28' ' ' TYR . 38.8 p90 -165.75 -167.41 1.1 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.902 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -119.18 125.25 48.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.067 -179.786 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.406 ' CZ ' ' OD2' ' A' ' 23' ' ' ASP . 0.4 OUTLIER -121.6 123.39 41.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.55 179.714 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.478 ' HA ' ' O ' ' A' ' 41' ' ' ASN . 1.3 m -99.89 136.27 40.05 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.828 -179.565 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -152.04 142.76 22.86 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.707 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER 53.37 41.4 32.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.674 -179.761 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 60.3 50.56 66.3 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.521 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.478 ' O ' ' HA ' ' A' ' 37' ' ' THR . 60.0 m-80 -154.37 154.11 32.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.706 0.288 . . . . 0.0 111.024 179.993 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.501 ' C ' ' CD1' ' A' ' 43' ' ' LEU . . . -100.46 111.12 23.34 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.91 179.882 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.528 ' N ' ' CD1' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -119.94 131.4 55.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.385 -179.631 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.492 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.4 t -77.83 128.61 38.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 178.762 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.561 ' SG ' ' CE1' ' A' ' 54' ' ' PHE . 1.5 m -110.1 144.19 39.07 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.014 0.435 . . . . 0.0 111.592 -179.151 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.449 ' O ' ' CD1' ' A' ' 48' ' ' TYR . 29.3 m -134.53 110.42 9.34 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.764 179.442 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.42 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 15.2 t -67.54 138.31 56.4 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.954 -179.691 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.526 ' O ' ' CG2' ' A' ' 30' ' ' ILE . 2.0 m-85 -105.38 -51.85 2.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.958 179.984 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 128.27 -179.69 16.4 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.427 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 41.15 -121.45 2.09 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.452 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -108.29 2.48 22.67 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.667 0.27 . . . . 0.0 111.093 -179.989 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.425 ' O ' ' O ' ' A' ' 53' ' ' GLY . 61.5 mtt180 -59.24 -42.09 90.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.944 179.986 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . 0.425 ' O ' ' O ' ' A' ' 52' ' ' ARG . . . 59.04 143.71 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.431 -179.921 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.561 ' CE1' ' SG ' ' A' ' 45' ' ' CYS . 1.3 p90 -58.03 150.28 21.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.943 0.401 . . . . 0.0 110.947 -179.926 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -104.46 -33.96 8.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.652 179.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.492 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.1 OUTLIER 59.27 148.29 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.051 179.864 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -130.08 -88.9 0.49 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.963 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.465 ' HA ' ' HA ' ' A' ' 43' ' ' LEU . 0.4 OUTLIER -158.0 -162.96 1.22 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.874 -179.967 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.217 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.974 -179.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.441 ' CD ' ' CG2' ' A' ' 65' ' ' THR . 0.2 OUTLIER . . . . . 0 N--CA 1.447 -0.602 0 CA-C-O 120.81 0.338 . . . . 0.0 111.134 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 46.83 62.35 2.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.904 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.441 ' CG2' ' CD ' ' A' ' 63' ' ' GLU . 7.3 t -178.31 -160.11 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.189 -179.931 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.432 ' N ' HG23 ' A' ' 65' ' ' THR . 2.0 p -175.63 -178.0 1.04 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.869 -179.94 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -136.94 107.1 6.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.976 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . 0.498 ' O ' ' N ' ' A' ' 72' ' ' GLY . 12.2 t70 -78.29 67.02 4.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.745 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 10.9 ptmt -41.27 -32.16 0.27 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.026 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . 0.458 ' CD1' ' N ' ' A' ' 70' ' ' TYR . 1.7 m-30 -57.17 -33.13 67.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.858 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 3.9 m -126.46 -43.24 1.76 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.175 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . 0.498 ' N ' ' O ' ' A' ' 68' ' ' ASP . . . 111.37 1.61 27.89 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.476 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -89.22 111.69 22.55 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.731 0.3 . . . . 0.0 110.892 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' THR . . . . . 0.423 HG22 ' O ' ' A' ' 66' ' ' CYS . 55.5 m -64.81 128.67 36.73 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.018 179.878 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.442 ' CE2' ' HB2' ' A' ' 68' ' ' ASP . 27.7 m-85 -116.19 -171.65 2.03 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.769 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 5.7 ttt180 -103.24 129.97 50.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.808 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.443 ' HA ' ' O ' ' A' ' 94' ' ' CYS . 14.0 p -49.44 -36.63 10.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.211 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -78.2 5.92 52.7 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.525 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.17 119.44 37.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.854 0.359 . . . . 0.0 110.961 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -94.83 146.91 23.88 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.165 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . 0.468 ' CE2' ' OD1' ' A' ' 68' ' ' ASP . 3.0 p90 -146.86 121.84 10.04 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.91 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.13 148.91 25.88 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.814 179.883 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.404 ' O ' ' HG2' ' A' ' 85' ' ' LYS . 0.0 OUTLIER -152.52 118.63 3.03 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.002 179.963 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.416 ' HA ' ' HA ' ' A' ' 89' ' ' ILE . 50.5 Cg_exo -53.81 85.93 0.03 OUTLIER 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 122.706 2.271 . . . . 0.0 112.22 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.452 ' O ' ' N ' ' A' ' 87' ' ' SER . 8.4 mmtm -87.59 160.94 18.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.976 -179.839 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 49.7 m-20 45.37 -92.02 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.022 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' SER . . . . . 0.452 ' N ' ' O ' ' A' ' 85' ' ' LYS . 1.4 m -143.83 20.65 1.81 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.963 -179.935 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 10.6 ttm -152.03 173.33 15.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.795 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.45 ' O ' ' HA ' ' A' ' 106' ' ' ILE . 1.8 mt -101.22 125.95 55.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.143 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' TRP . . . . . 0.622 ' N ' ' CD1' ' A' ' 90' ' ' TRP . 0.2 OUTLIER -126.14 130.29 50.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.854 -179.937 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.46 ' N ' ' O ' ' A' ' 105' ' ' THR . 24.7 t0 -65.59 63.61 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.838 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . 0.469 ' N ' ' O ' ' A' ' 90' ' ' TRP . 8.3 m -51.13 93.38 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.991 -179.91 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' THR . . . . . 0.475 ' N ' ' O ' ' A' ' 103' ' ' SER . 0.2 OUTLIER -82.9 130.26 35.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.021 179.936 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . 0.443 ' O ' ' HA ' ' A' ' 77' ' ' VAL . 0.7 OUTLIER -75.91 56.89 1.0 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.997 -179.847 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.445 HG13 ' HB ' ' A' ' 93' ' ' THR . 2.0 mt -73.54 72.62 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.12 179.96 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -127.74 84.29 0.33 Allowed Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.563 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -121.99 80.71 1.73 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.852 0.358 . . . . 0.0 111.054 179.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 113.72 6.75 20.94 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.398 -179.835 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -164.86 -60.55 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.837 0.351 . . . . 0.0 110.854 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 114.45 80.19 0.91 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.475 -179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.92 102.53 7.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.791 0.329 . . . . 0.0 110.942 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . 0.494 ' N ' HD12 ' A' ' 102' ' ' ILE . 2.5 mm -85.1 76.36 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.159 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' SER . . . . . 0.475 ' O ' ' N ' ' A' ' 93' ' ' THR . 3.3 t -63.24 135.51 57.13 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.935 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . 0.462 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 39.4 m -124.73 152.63 43.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.818 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' THR . . . . . 0.46 ' O ' ' N ' ' A' ' 91' ' ' ASP . 2.7 t -162.11 141.28 9.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.157 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.45 ' HA ' ' O ' ' A' ' 89' ' ' ILE . 0.8 OUTLIER -68.06 149.0 11.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.064 179.846 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -156.87 136.71 12.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.154 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -112.34 114.55 27.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.959 -179.915 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 11.0 mmt180 . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.153 -0.927 . . . . 0.0 110.899 179.856 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo . . . . . 0 N--CA 1.464 -0.248 0 CA-C-O 120.756 0.232 . . . . 0.0 112.436 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 119.82 168.44 13.86 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.706 179.958 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 98.0 m -118.42 109.85 16.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.806 0.336 . . . . 0.0 110.84 179.924 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 79.5 t80 -96.67 116.32 28.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.954 -179.904 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -159.22 153.51 23.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.885 -179.971 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.427 ' O ' ' CG ' ' A' ' 24' ' ' ASN . 23.7 t-20 55.89 33.65 22.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.896 179.998 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 68.42 12.8 64.29 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.555 -179.982 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.469 ' HB3' ' CE1' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -123.07 140.57 52.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.834 0.35 . . . . 0.0 110.918 179.983 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 5.6 t-160 -116.1 91.86 3.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.003 -179.826 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.582 ' CE2' ' CE2' ' A' ' 34' ' ' TRP . 0.1 OUTLIER -81.2 -179.2 7.25 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.019 179.932 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.519 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 0.0 OUTLIER -110.42 145.08 38.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.835 179.946 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.463 ' HA ' ' SG ' ' A' ' 47' ' ' CYS . 3.7 mp -41.26 148.27 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.395 -179.898 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.429 ' HB2' ' O ' ' A' ' 30' ' ' ILE . 71.5 m-80 66.63 12.92 9.09 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.136 179.801 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.519 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 56.1 tt0 -101.67 155.62 18.0 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.014 0.435 . . . . 0.0 111.23 -179.973 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.472 ' HG2' ' OG1' ' A' ' 46' ' ' THR . 23.2 mt-30 -119.34 158.83 25.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.632 179.944 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . 0.582 ' CE2' ' CE2' ' A' ' 28' ' ' TYR . 43.8 p90 -162.95 176.07 10.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.03 -179.964 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -107.11 113.69 27.3 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.087 -179.872 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.517 ' N ' ' O ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -97.48 178.18 5.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.805 179.92 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -147.39 140.58 25.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.667 -179.796 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.44 ' HB2' HD23 ' A' ' 43' ' ' LEU . 11.7 t80 -160.12 140.07 11.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.729 179.808 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 57.0 23.85 8.82 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.784 -179.879 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 75.52 32.86 53.95 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.888 -0.673 . . . . 0.0 112.747 179.819 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.461 ' O ' HD11 ' A' ' 43' ' ' LEU . 91.0 m-20 -136.38 148.36 47.79 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 120.875 0.369 . . . . 0.0 110.984 179.796 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -71.65 133.82 45.94 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.767 179.841 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.517 ' O ' ' N ' ' A' ' 36' ' ' ARG . 10.0 mp -126.44 153.34 45.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.358 -179.649 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.47 ' O ' ' HB3' ' A' ' 56' ' ' CYS . 2.2 t -113.02 124.14 69.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.026 -0.534 . . . . 0.0 109.904 179.033 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.569 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 9.4 m -113.28 161.71 16.89 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.902 -178.838 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.484 ' O ' ' CE1' ' A' ' 48' ' ' TYR . 55.2 m -151.63 109.87 3.74 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.664 179.638 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.534 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 16.9 t -66.83 145.22 55.72 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.971 -179.765 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.484 ' CE1' ' O ' ' A' ' 46' ' ' THR . 4.0 m-85 -115.47 -42.51 3.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.852 -179.956 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 149.32 41.16 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.422 -179.901 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 49.42 47.49 35.6 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.487 -179.958 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 71.1 p -156.04 -58.9 0.1 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.841 0.353 . . . . 0.0 110.785 -179.977 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 13.7 mtp180 -75.96 1.17 16.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.078 179.984 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 62.35 116.89 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.743 -0.742 . . . . 0.0 112.519 179.948 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.567 ' CG ' ' O ' ' A' ' 54' ' ' PHE . 15.1 p90 -56.47 99.03 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.832 0.348 . . . . 0.0 110.836 179.976 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -72.45 140.56 48.36 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.955 -179.919 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.496 ' SG ' ' CD2' ' A' ' 54' ' ' PHE . 2.3 m -145.99 175.18 10.64 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.933 -179.916 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -171.03 -174.17 1.46 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.918 -179.95 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.414 ' O ' ' C ' ' A' ' 59' ' ' LYS . 5.0 p -79.77 136.24 36.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.876 179.993 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.414 ' C ' ' O ' ' A' ' 58' ' ' SER . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.902 -179.927 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.455 -0.219 0 CA-C-O 120.843 0.354 . . . . 0.0 110.697 . . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.426 ' OE2' ' NE ' ' A' ' 76' ' ' ARG . 3.0 tt0 -73.62 88.09 1.68 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.887 -179.888 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.496 ' OG1' ' N ' ' A' ' 66' ' ' CYS . 0.5 OUTLIER -168.58 176.63 5.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.079 179.918 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.496 ' N ' ' OG1' ' A' ' 65' ' ' THR . 0.1 OUTLIER 177.53 -66.07 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.923 -179.949 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.438 ' O ' ' N ' ' A' ' 69' ' ' LYS . 46.2 t80 63.28 74.82 0.41 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.951 179.935 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . 0.514 ' O ' ' N ' ' A' ' 72' ' ' GLY . 15.0 t70 -41.27 95.19 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.85 179.982 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.438 ' N ' ' O ' ' A' ' 67' ' ' PHE . 2.2 pttm -57.11 -17.41 10.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.916 -179.926 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -65.84 -56.27 12.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.102 -179.866 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.99 7.04 14.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.277 -179.904 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . 0.514 ' N ' ' O ' ' A' ' 68' ' ' ASP . . . 59.77 31.62 72.15 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.382 179.947 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -84.05 -172.96 4.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.852 0.358 . . . . 0.0 110.773 179.93 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 15.8 m -111.03 79.06 1.16 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.968 179.925 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.459 ' CD2' ' HB2' ' A' ' 68' ' ' ASP . 11.1 m-30 -89.46 169.56 11.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.893 -179.99 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . 0.426 ' NE ' ' OE2' ' A' ' 64' ' ' GLU . 0.0 OUTLIER -128.01 135.97 50.63 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.766 -179.966 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.449 ' HA ' ' O ' ' A' ' 94' ' ' CYS . 2.3 p -48.53 -26.53 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.945 -179.965 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -90.1 8.25 80.14 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.513 -179.955 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -125.43 127.51 46.64 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.849 0.357 . . . . 0.0 110.787 179.966 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 5.0 t -103.35 150.8 23.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.148 -179.874 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . 0.498 ' O ' ' CG ' ' A' ' 81' ' ' TYR . 25.9 p90 -140.84 112.09 7.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.824 179.844 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.486 ' CB ' ' OD1' ' A' ' 91' ' ' ASP . 6.1 pt-20 -86.12 136.12 33.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.974 -179.835 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.42 ' HA ' ' HD2' ' A' ' 84' ' ' PRO . 4.4 mtt180 -110.59 106.79 58.04 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.815 -179.991 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.454 ' HA ' HG12 ' A' ' 89' ' ' ILE . 34.0 Cg_endo -64.62 88.35 0.17 Allowed 'Trans proline' 0 C--O 1.231 0.156 0 C-N-CA 122.784 2.323 . . . . 0.0 112.283 179.983 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 2.4 mttm -126.74 126.32 43.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.934 179.995 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.491 ' CB ' ' SD ' ' A' ' 88' ' ' MET . 0.4 OUTLIER 67.92 177.42 0.25 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.841 179.905 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.2 m -84.99 55.58 3.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.945 -179.987 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 88' ' ' MET . . . . . 0.491 ' SD ' ' CB ' ' A' ' 86' ' ' ASP . 0.0 OUTLIER -150.23 -47.41 0.13 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.83 -179.947 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.484 ' C ' ' CD1' ' A' ' 90' ' ' TRP . 35.6 mt 62.76 137.4 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.839 179.97 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 90' ' ' TRP . . . . . 0.604 ' N ' ' CD1' ' A' ' 90' ' ' TRP . 0.1 OUTLIER -142.67 124.55 15.16 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.934 -179.881 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.486 ' OD1' ' CB ' ' A' ' 82' ' ' GLU . 93.8 m-20 -75.21 72.89 2.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.939 179.983 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . 0.464 ' HA ' ' O ' ' A' ' 103' ' ' SER . 0.1 OUTLIER -52.34 99.19 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.956 179.879 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 2.5 m -80.88 127.92 33.09 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.008 179.903 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . 0.458 ' HA ' HD12 ' A' ' 102' ' ' ILE . 1.8 t -70.49 72.55 0.5 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.989 -179.856 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 1.9 mt -67.99 149.12 11.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.162 179.97 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -159.92 -102.82 0.18 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.644 -179.947 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . 48.69 37.78 10.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.836 0.351 . . . . 0.0 111.019 -179.914 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 120.43 -38.42 2.74 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.506 179.999 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.22 99.78 6.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.769 0.318 . . . . 0.0 110.882 -179.926 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -69.96 77.62 0.41 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.433 179.93 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -120.8 93.73 4.12 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.805 0.336 . . . . 0.0 110.961 -179.983 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . 0.458 HD12 ' HA ' ' A' ' 94' ' ' CYS . 6.6 mm -60.75 123.91 14.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.124 179.906 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 103' ' ' SER . . . . . 0.464 ' O ' ' HA ' ' A' ' 92' ' ' CYS . 25.3 t -105.93 125.81 51.44 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.991 -179.92 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . 0.441 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 0.5 OUTLIER -102.27 86.5 2.84 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.962 -179.924 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 4.7 t -73.12 131.75 42.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.113 179.918 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.563 ' HB ' ' CZ3' ' A' ' 90' ' ' TRP . 0.9 OUTLIER -62.87 148.78 10.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.959 179.794 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . 0.432 ' HB2' ' O ' ' A' ' 89' ' ' ILE . . . -77.6 168.52 19.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.019 179.941 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -175.54 145.1 0.71 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.891 -179.961 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 4.1 mtt180 . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.855 -179.98 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_exo . . . . . 0 C--O 1.232 0.178 0 CA-C-O 120.755 0.231 . . . . 0.0 112.256 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . 0.471 ' HA2' HD13 ' A' ' 30' ' ' ILE . . . 82.33 122.87 0.72 Allowed Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.572 179.947 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.468 ' O ' ' HB2' ' A' ' 22' ' ' TYR . 11.7 m -79.49 -179.91 7.09 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.83 0.347 . . . . 0.0 110.752 179.781 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.468 ' HB2' ' O ' ' A' ' 21' ' ' CYS . 85.7 t80 174.93 119.35 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.919 179.942 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -153.95 156.89 38.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.856 -179.996 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.4 ' CG ' ' O ' ' A' ' 24' ' ' ASN . 29.3 t-20 48.35 27.47 1.37 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.88 -179.943 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.06 -3.55 70.56 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.523 179.965 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.57 ' HB3' ' CZ ' ' A' ' 28' ' ' TYR . 0.9 OUTLIER -91.95 135.52 33.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.837 0.351 . . . . 0.0 110.852 -179.986 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 3.9 t-160 -113.47 90.82 3.44 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.997 -179.984 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.57 ' CZ ' ' HB3' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -84.98 142.61 29.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.988 179.938 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.526 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 6.7 mt-30 -76.39 147.0 38.32 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.587 179.771 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.529 ' CD1' ' SG ' ' A' ' 47' ' ' CYS . 7.6 mm -49.5 147.59 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.961 0.41 . . . . 0.0 110.982 179.979 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.423 ' CG ' HG21 ' A' ' 30' ' ' ILE . 61.3 m-20 67.1 7.77 5.67 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.042 179.956 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.526 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 1.5 tt0 -92.76 151.79 19.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.849 0.356 . . . . 0.0 110.9 179.932 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -124.8 136.54 53.92 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.043 -179.826 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . 0.573 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 19.3 p90 -134.86 -170.96 2.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.759 179.876 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.459 ' HG3' HG22 ' A' ' 44' ' ' VAL . 2.2 mt-10 -130.76 125.17 33.12 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.922 0.391 . . . . 0.0 111.159 -179.868 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.466 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 0.1 OUTLIER -122.85 172.89 8.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.74 179.742 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -126.37 143.94 51.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.757 -179.769 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.507 ' CB ' HD22 ' A' ' 43' ' ' LEU . 1.7 t80 -155.92 125.45 6.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.611 179.769 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 74.36 14.61 3.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.522 -179.879 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 80.01 45.49 8.27 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.611 -179.957 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 7.5 m-80 -149.46 168.33 23.74 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 120.789 0.328 . . . . 0.0 110.995 179.865 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -82.82 132.08 35.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.953 179.805 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.507 HD22 ' CB ' ' A' ' 38' ' ' TYR . 10.3 mp -136.52 146.28 46.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.972 0.415 . . . . 0.0 111.311 -179.718 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.478 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.4 t -114.74 130.6 68.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.139 179.05 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.573 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 1.3 m -112.06 166.54 11.15 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.096 0.474 . . . . 0.0 111.537 -179.323 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.457 ' O ' ' HA ' ' A' ' 54' ' ' PHE . 27.9 m -143.52 147.56 34.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.663 -0.698 . . . . 0.0 110.69 179.704 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.568 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 21.9 t -106.88 143.91 34.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.937 -179.825 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.44 ' N ' ' CD1' ' A' ' 48' ' ' TYR . 3.1 m-85 -130.37 -47.08 1.08 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.919 179.906 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.506 ' CA ' HD12 ' A' ' 30' ' ' ILE . . . 99.91 -50.22 1.12 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.793 -0.718 . . . . 0.0 112.428 -179.921 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -70.46 -152.88 0.91 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.486 179.913 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.12 -6.14 45.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.7 0.286 . . . . 0.0 111.016 179.986 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 1.3 mtt180 -62.68 -38.25 89.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.106 -179.932 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 61.42 155.82 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.657 -0.782 . . . . 0.0 112.303 -179.887 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.558 ' CE1' ' SG ' ' A' ' 45' ' ' CYS . 0.2 OUTLIER -72.88 126.59 30.29 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.794 0.33 . . . . 0.0 110.818 -179.966 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 43.9 m-80 -120.47 118.27 29.84 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.767 179.97 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.478 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.1 OUTLIER -89.28 167.27 13.2 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.061 -179.837 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -151.24 151.04 31.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.836 179.938 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.462 ' O ' ' O ' ' A' ' 59' ' ' LYS . 4.9 p -72.19 77.94 0.97 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.968 -179.933 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.462 ' O ' ' O ' ' A' ' 58' ' ' SER . 12.3 tptt . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.048 179.883 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.454 -0.256 0 CA-C-O 120.783 0.325 . . . . 0.0 110.481 . . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.411 ' HB3' HG11 ' A' ' 77' ' ' VAL . 1.8 mp0 -151.53 122.31 7.52 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.964 -179.866 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.463 ' O ' ' HA3' ' A' ' 96' ' ' GLY . 0.0 OUTLIER -173.91 -172.01 0.69 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.0 179.96 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 1.7 p -171.5 171.47 5.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.961 179.959 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -160.6 106.74 1.49 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.027 179.998 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 50.2 t0 -70.44 88.05 0.65 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.825 179.965 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.426 ' O ' ' C ' ' A' ' 70' ' ' TYR . 0.5 OUTLIER -59.35 -37.44 77.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.997 -179.975 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . 0.426 ' C ' ' O ' ' A' ' 69' ' ' LYS . 10.5 m-30 -36.13 -40.57 0.22 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.863 179.949 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 91.2 m -121.58 -30.45 4.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.138 179.88 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 107.18 14.14 19.39 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.37 -179.924 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 15.4 m-20 -92.73 176.81 6.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.923 0.392 . . . . 0.0 110.967 179.981 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 74' ' ' THR . . . . . 0.405 HG23 ' N ' ' A' ' 75' ' ' TYR . 90.0 m -132.85 136.41 46.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.959 179.88 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.459 ' CD2' ' CE2' ' A' ' 81' ' ' TYR . 34.7 m-85 -128.38 -170.72 2.3 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.74 -179.972 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 31.1 mtt-85 -99.18 124.52 44.3 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.808 179.921 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.411 HG11 ' HB3' ' A' ' 64' ' ' GLU . 7.3 p -54.0 -27.27 15.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.169 -179.93 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -79.83 -4.99 89.63 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.578 -179.979 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -123.17 -174.52 2.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.833 0.349 . . . . 0.0 110.98 -179.989 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 13.6 t -144.63 -174.68 4.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.979 -179.98 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . 0.459 ' CE2' ' CD2' ' A' ' 75' ' ' TYR . 33.3 p90 -159.92 153.85 23.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.952 179.963 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 54.4 tt0 -82.88 140.77 32.69 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.875 179.98 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.43 110.43 9.7 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.971 -179.883 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -74.32 98.36 1.1 Allowed 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 122.736 2.291 . . . . 0.0 112.381 179.977 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.402 ' O ' ' CB ' ' A' ' 86' ' ' ASP . 0.1 OUTLIER -131.55 123.26 27.59 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.91 -179.993 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.402 ' CB ' ' O ' ' A' ' 85' ' ' LYS . 2.6 t0 77.31 -155.18 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.924 179.954 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 59.3 p -85.26 -3.24 58.75 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.125 179.925 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 2.7 tpt -128.09 163.91 23.58 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.889 -179.949 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.514 ' C ' ' CD1' ' A' ' 90' ' ' TRP . 2.3 mp -106.23 152.45 7.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.052 179.88 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 90' ' ' TRP . . . . . 0.618 ' N ' ' CD1' ' A' ' 90' ' ' TRP . 0.1 OUTLIER -143.81 141.81 30.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.963 -179.986 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -91.34 70.85 6.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.924 179.963 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . 0.419 ' HA ' ' HA ' ' A' ' 104' ' ' CYS . 72.1 m -47.9 99.95 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.039 -179.958 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.26 122.29 19.97 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.879 179.896 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -63.76 86.47 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.938 -179.84 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.463 HG22 ' O ' ' A' ' 100' ' ' GLY . 1.1 mt -100.0 102.11 13.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.147 -179.948 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . 0.467 ' O ' ' HA3' ' A' ' 100' ' ' GLY . . . -112.08 -136.53 6.86 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.706 -179.969 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.448 ' CB ' ' O ' ' A' ' 96' ' ' GLY . . . 79.76 -157.46 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.632 0.253 . . . . 0.0 110.875 -179.776 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -42.36 -30.83 0.87 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.515 -0.85 . . . . 0.0 112.204 179.871 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.51 ' O ' ' N ' ' A' ' 101' ' ' ARG . 3.9 ttp180 -155.69 -55.03 0.09 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.846 0.355 . . . . 0.0 110.377 179.824 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . 0.467 ' HA3' ' O ' ' A' ' 96' ' ' GLY . . . 58.14 -75.22 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.952 -0.642 . . . . 0.0 112.779 179.667 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.521 ' O ' ' CD ' ' A' ' 101' ' ' ARG . 0.0 OUTLIER 69.11 87.07 0.12 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.831 0.348 . . . . 0.0 110.494 -179.733 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 3.7 mp -41.2 122.13 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.18 179.96 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 103' ' ' SER . . . . . 0.491 ' HB2' ' NH2' ' A' ' 101' ' ' ARG . 19.5 t -105.38 133.01 50.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.929 -179.913 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . 0.419 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 38.3 m -112.32 132.1 55.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.883 179.902 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 105' ' ' THR . . . . . 0.407 ' O ' ' HA ' ' A' ' 90' ' ' TRP . 5.0 t -140.72 143.67 35.14 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.216 -179.931 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.463 ' HA ' ' O ' ' A' ' 89' ' ' ILE . 5.8 mt -47.91 155.24 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.902 179.919 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . 0.449 ' N ' HG23 ' A' ' 106' ' ' ILE . . . -90.59 111.95 23.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.059 -179.99 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -92.65 154.52 18.32 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.863 -179.941 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 15.1 ptt85 . . . . . 0 C--O 1.248 0.985 0 CA-C-O 118.273 -0.87 . . . . 0.0 110.875 -179.919 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo . . . . . 0 C--O 1.231 0.132 0 CA-C-O 120.854 0.273 . . . . 0.0 112.178 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 152.18 -162.06 29.64 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.514 -179.976 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 17.1 m -152.67 97.92 2.29 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.916 0.388 . . . . 0.0 110.819 179.979 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -71.83 135.21 46.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.982 -179.986 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . 0.41 ' HB3' ' ND2' ' A' ' 24' ' ' ASN . 0.2 OUTLIER -157.48 121.98 4.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.95 179.995 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.41 ' ND2' ' HB3' ' A' ' 23' ' ' ASP . 3.1 p30 44.62 47.42 8.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.048 179.934 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 71.11 2.17 45.79 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.638 179.924 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.405 ' N ' ' O ' ' A' ' 23' ' ' ASP . 0.0 OUTLIER -103.26 133.33 48.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.834 0.349 . . . . 0.0 110.906 179.961 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -116.73 91.94 3.73 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.963 -179.769 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.598 ' CE2' ' CE2' ' A' ' 34' ' ' TRP . 3.2 m-85 -79.79 130.52 35.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.946 -179.955 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.48 ' O ' ' HB2' ' A' ' 32' ' ' GLN . 3.2 tt0 -63.25 135.05 56.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.599 179.891 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.504 ' CG1' ' HA2' ' A' ' 49' ' ' GLY . 4.2 mp -31.85 139.07 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.512 -179.924 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . 0.484 ' HB2' ' O ' ' A' ' 30' ' ' ILE . 61.0 m-20 78.11 0.74 2.72 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.124 -179.78 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.48 ' HB2' ' O ' ' A' ' 29' ' ' GLN . 6.3 mm100 -76.94 141.71 40.36 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.819 0.342 . . . . 0.0 110.885 179.81 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . 0.41 ' HG2' HG21 ' A' ' 46' ' ' THR . 11.4 mt-30 -114.13 132.33 56.1 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.037 -179.962 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . 0.598 ' CE2' ' CE2' ' A' ' 28' ' ' TYR . 42.6 p90 -148.61 -168.46 3.1 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.921 -179.935 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.449 ' HG3' HG23 ' A' ' 44' ' ' VAL . 0.0 OUTLIER -122.44 132.78 54.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.967 -179.799 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.532 ' O ' ' CD2' ' A' ' 43' ' ' LEU . 0.4 OUTLIER -119.95 167.56 12.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.773 179.879 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -109.43 164.23 12.69 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.086 -179.86 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . 0.435 ' HB2' HD23 ' A' ' 43' ' ' LEU . 0.1 OUTLIER -156.14 93.01 1.39 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.651 179.91 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.405 ' HB2' ' O ' ' A' ' 38' ' ' TYR . 0.8 OUTLIER 67.2 18.59 10.36 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.694 -179.707 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 107.11 8.97 30.67 Favored Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.62 179.996 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 50.1 m-80 -94.78 -173.11 2.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.852 0.358 . . . . 0.0 111.018 -179.908 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.442 ' C ' ' CD1' ' A' ' 43' ' ' LEU . . . -135.48 107.83 7.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.924 179.844 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.585 ' N ' ' CD1' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -121.89 157.59 30.85 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.156 -179.889 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.468 ' O ' ' HB3' ' A' ' 56' ' ' CYS . 2.8 t -95.8 132.09 40.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.176 -0.466 . . . . 0.0 109.934 179.122 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.52 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 1.8 m -114.29 157.17 23.12 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.738 -179.092 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.45 ' HA ' ' O ' ' A' ' 32' ' ' GLN . 4.6 m -146.18 130.81 17.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.599 179.545 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.488 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 20.0 t -83.79 139.16 32.87 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.029 -179.644 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.472 ' CD1' ' O ' ' A' ' 53' ' ' GLY . 5.5 m-85 -119.56 -14.93 9.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.967 -179.925 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.504 ' HA2' ' CG1' ' A' ' 30' ' ' ILE . . . 132.09 -165.22 23.6 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.557 179.94 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . 0.514 ' O ' ' CB ' ' A' ' 51' ' ' SER . . . -91.98 67.09 2.12 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.534 -179.977 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 51' ' ' SER . . . . . 0.514 ' CB ' ' O ' ' A' ' 50' ' ' GLY . 0.1 OUTLIER 159.66 -51.73 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.756 0.312 . . . . 0.0 110.908 179.99 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 9.5 mtt-85 -57.27 -19.08 19.54 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.904 179.925 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . 0.472 ' O ' ' CD1' ' A' ' 48' ' ' TYR . . . 73.54 172.46 24.76 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.597 179.832 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.577 ' CG ' ' O ' ' A' ' 54' ' ' PHE . 11.3 p90 -114.23 96.59 5.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.828 0.346 . . . . 0.0 110.838 179.989 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 61.0 m-20 -71.14 138.31 49.54 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.708 179.991 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.506 ' SG ' ' CD2' ' A' ' 54' ' ' PHE . 3.0 m -144.2 162.11 37.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.942 0.401 . . . . 0.0 111.231 -179.648 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . 0.458 ' O ' ' O ' ' A' ' 58' ' ' SER . 0.5 OUTLIER -162.72 160.9 26.03 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.771 179.857 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 58' ' ' SER . . . . . 0.458 ' O ' ' O ' ' A' ' 57' ' ' GLU . 0.6 OUTLIER -37.3 161.01 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.945 179.993 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.034 -179.932 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 . . . . . 0 N--CA 1.454 -0.231 0 CA-C-O 120.824 0.345 . . . . 0.0 110.609 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.46 ' HG3' ' HB ' ' A' ' 77' ' ' VAL . 5.8 tt0 66.26 114.37 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.921 179.86 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.438 ' CG2' ' O ' ' A' ' 64' ' ' GLU . 0.2 OUTLIER 171.82 169.33 0.1 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.195 179.985 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.423 ' HB2' ' C ' ' A' ' 75' ' ' TYR . 0.8 OUTLIER -153.05 -175.09 5.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.783 179.98 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -129.78 -37.22 1.55 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.943 -179.928 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . 0.445 ' O ' ' O ' ' A' ' 69' ' ' LYS . 27.3 t0 59.98 63.99 1.35 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.806 179.997 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.445 ' O ' ' O ' ' A' ' 68' ' ' ASP . 9.7 ptmt -45.44 176.07 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.882 179.98 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . 0.552 ' CE2' ' HE2' ' A' ' 85' ' ' LYS . 20.4 m-85 65.37 17.78 11.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.955 -179.997 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.471 ' CG2' ' O ' ' A' ' 70' ' ' TYR . 0.7 OUTLIER -177.75 -34.47 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.218 -179.994 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 80.04 42.62 10.64 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.553 -179.991 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . 0.409 ' O ' ' CB ' ' A' ' 68' ' ' ASP . 0.1 OUTLIER -100.58 116.12 31.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.791 0.329 . . . . 0.0 110.855 179.97 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 74' ' ' THR . . . . . 0.43 ' O ' ' NH2' ' A' ' 76' ' ' ARG . 5.2 m -70.61 100.47 1.84 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.101 179.957 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.423 ' C ' ' HB2' ' A' ' 66' ' ' CYS . 3.9 m-30 -92.29 -174.49 3.74 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.853 -179.953 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . 0.43 ' NH2' ' O ' ' A' ' 74' ' ' THR . 0.6 OUTLIER -129.69 157.71 41.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.808 179.938 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.46 ' HB ' ' HG3' ' A' ' 64' ' ' GLU . 75.7 t -63.67 -20.57 26.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.136 179.941 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -91.18 31.0 5.91 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.461 179.933 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -148.9 148.44 29.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.882 0.372 . . . . 0.0 111.114 179.971 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.445 HG22 HG21 ' A' ' 93' ' ' THR . 80.6 p -125.39 169.61 12.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.026 179.974 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . 0.409 ' O ' ' O ' ' A' ' 92' ' ' CYS . 11.0 p90 -174.29 134.92 0.43 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.936 179.96 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 11.6 mp0 -87.82 165.39 15.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.968 -179.996 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . 0.496 ' NE ' ' HD2' ' A' ' 84' ' ' PRO . 0.0 OUTLIER -148.3 113.13 3.8 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.772 179.966 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.496 ' HD2' ' NE ' ' A' ' 83' ' ' ARG . 37.4 Cg_endo -66.2 74.1 0.36 Allowed 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.699 2.266 . . . . 0.0 112.254 179.986 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.552 ' HE2' ' CE2' ' A' ' 70' ' ' TYR . 4.9 mmtt -100.08 131.06 46.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.871 -179.959 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 9.5 t0 57.23 -173.85 0.08 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.778 179.962 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 87' ' ' SER . . . . . 0.46 ' O ' ' HB2' ' A' ' 88' ' ' MET . 8.5 m -72.48 58.58 0.41 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.958 179.967 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 88' ' ' MET . . . . . 0.46 ' HB2' ' O ' ' A' ' 87' ' ' SER . 1.9 ttm 176.48 166.93 0.47 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.859 -179.999 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 1.9 mp -123.84 146.18 29.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.108 179.989 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 90' ' ' TRP . . . . . 0.623 ' N ' ' CD1' ' A' ' 90' ' ' TRP . 0.0 OUTLIER -137.09 139.17 41.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.811 -179.941 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -77.91 63.36 2.91 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.757 179.889 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . 0.435 ' HA ' ' O ' ' A' ' 103' ' ' SER . 3.8 m -44.88 112.52 0.44 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.163 -179.895 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 93' ' ' THR . . . . . 0.512 ' N ' ' O ' ' A' ' 103' ' ' SER . 0.9 OUTLIER -96.48 143.49 27.45 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.78 179.771 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . 0.424 ' SG ' ' O ' ' A' ' 76' ' ' ARG . 3.5 t -74.58 81.44 1.99 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.047 -179.822 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.502 ' CG1' ' HB2' ' A' ' 103' ' ' SER . 2.6 mt -101.51 145.11 12.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.209 179.987 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 116.05 146.43 8.67 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.499 -179.914 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -89.27 45.32 1.28 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.806 0.336 . . . . 0.0 111.154 -179.91 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 142.05 -9.45 2.5 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.649 179.849 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.518 ' O ' ' N ' ' A' ' 101' ' ' ARG . 0.9 OUTLIER 173.6 -40.84 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.782 0.325 . . . . 0.0 110.936 -179.983 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . 0.404 ' C ' ' O ' ' A' ' 99' ' ' ARG . . . 38.16 -91.5 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.384 -179.958 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.518 ' N ' ' O ' ' A' ' 99' ' ' ARG . 0.0 OUTLIER -179.03 33.68 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.748 0.309 . . . . 0.0 110.982 179.758 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . 0.451 ' C ' ' O ' ' A' ' 101' ' ' ARG . 3.2 mt 28.55 89.26 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.671 179.756 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 103' ' ' SER . . . . . 0.512 ' O ' ' N ' ' A' ' 93' ' ' THR . 1.4 t -55.78 148.49 16.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.868 179.941 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . 0.447 ' SG ' ' O ' ' A' ' 103' ' ' SER . 18.5 m -157.17 142.82 17.52 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.973 -179.939 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -162.18 134.61 5.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.069 179.996 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.571 HG13 ' CE3' ' A' ' 90' ' ' TRP . 3.5 mt -51.15 142.12 3.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.086 179.887 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -63.0 170.22 2.87 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.126 179.929 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -96.87 95.19 7.69 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.945 179.999 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.247 -0.883 . . . . 0.0 110.924 179.969 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo . . . . . 0 N--CA 1.464 -0.237 0 CA-C-O 120.874 0.281 . . . . 0.0 112.522 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' GLY . . . . . 0.487 ' HA2' ' CD1' ' A' ' 30' ' ' ILE . . . 79.51 159.8 17.93 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.623 179.791 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.479 ' O ' ' CD2' ' A' ' 27' ' ' HIS . 1.6 m -92.03 174.3 7.39 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.743 0.306 . . . . 0.0 110.921 179.936 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 85.3 t80 177.61 143.98 0.1 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.864 -179.976 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 166.66 169.7 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.87 179.977 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.418 ' O ' ' CG ' ' A' ' 24' ' ' ASN . 35.1 t30 54.09 24.34 4.73 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.902 179.927 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 77.4 6.73 86.76 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.576 179.94 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.577 ' HB3' ' CE1' ' A' ' 28' ' ' TYR . 2.1 ttpt -119.74 149.48 41.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.75 0.309 . . . . 0.0 110.876 -179.985 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . 0.479 ' CD2' ' O ' ' A' ' 21' ' ' CYS . 3.0 t-160 -116.51 96.42 5.51 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.109 -179.834 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.577 ' CE1' ' HB3' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -90.73 171.53 9.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.96 -179.995 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.466 ' O ' ' HB2' ' A' ' 32' ' ' GLN . 0.1 OUTLIER -95.17 173.88 7.34 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.905 179.934 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.487 ' CD1' ' HA2' ' A' ' 20' ' ' GLY . 33.5 mm -72.45 148.41 9.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.166 -179.989 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 65.6 m-20 64.24 10.73 5.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.852 -179.918 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.466 ' HB2' ' O ' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -88.78 158.31 18.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.784 -179.999 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -119.29 138.59 52.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.956 -179.87 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . 0.536 ' CE2' ' HB2' ' A' ' 45' ' ' CYS . 37.2 p90 -149.59 -179.77 7.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.037 -179.904 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.47 ' HG2' ' O ' ' A' ' 43' ' ' LEU . 3.9 tt0 -117.58 128.82 55.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.577 -179.991 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 36' ' ' ARG . . . . . 0.527 ' O ' ' CD2' ' A' ' 43' ' ' LEU . 2.9 ttt180 -114.82 169.79 8.82 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.811 0.338 . . . . 0.0 110.965 -179.985 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.1 m -130.05 130.48 44.97 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.644 -179.916 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -147.74 143.78 27.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.791 179.85 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 51.24 35.28 13.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.681 -179.838 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 66.95 38.8 93.07 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.827 -0.701 . . . . 0.0 112.494 -179.89 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 36.3 m-20 -134.87 179.77 6.1 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 120.856 0.36 . . . . 0.0 110.934 -179.93 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -125.67 118.75 26.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.988 179.859 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.585 ' N ' ' CD1' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -124.9 163.67 21.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.961 0.41 . . . . 0.0 111.347 -179.871 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 44' ' ' VAL . . . . . 0.462 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.4 t -111.97 125.06 69.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.092 179.163 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.536 ' HB2' ' CE2' ' A' ' 34' ' ' TRP . 89.0 m -103.66 163.75 12.11 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.789 -178.874 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.441 ' O ' ' HA ' ' A' ' 54' ' ' PHE . 21.1 m -146.13 119.28 8.85 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.601 179.708 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.52 ' HB2' ' CH2' ' A' ' 34' ' ' TRP . 13.4 t -79.06 154.94 29.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.128 -179.61 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . 0.409 ' C ' HG22 ' A' ' 30' ' ' ILE . 15.4 m-85 -123.49 -47.66 1.97 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.851 179.908 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . 0.411 ' HA2' HD12 ' A' ' 30' ' ' ILE . . . 119.22 139.21 5.95 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.418 -179.888 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 78.04 -111.3 3.22 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.747 179.874 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -117.86 -4.14 11.14 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.721 0.296 . . . . 0.0 111.152 -179.81 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 6.5 mtt180 -55.57 -26.14 41.9 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.985 -179.896 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 69.01 -173.65 34.83 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.536 179.908 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . 0.579 ' CD1' ' O ' ' A' ' 54' ' ' PHE . 29.5 p90 -129.68 122.65 29.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.893 0.378 . . . . 0.0 111.007 -179.952 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -91.2 147.73 22.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.489 179.795 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.462 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.8 OUTLIER -137.35 156.51 48.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.926 0.393 . . . . 0.0 111.181 -179.834 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -144.59 133.56 22.63 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.797 179.923 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 22.9 t -37.43 130.52 0.95 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.057 179.972 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.87 179.899 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.441 ' O ' ' O ' ' A' ' 97' ' ' ALA . 1.2 tt0 . . . . . 0 N--CA 1.455 -0.196 0 CA-C-O 120.907 0.384 . . . . 0.0 110.505 . . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 64' ' ' GLU . . . . . 0.436 ' HG2' ' CG1' ' A' ' 77' ' ' VAL . 12.1 mt-10 -64.34 82.57 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.899 -179.77 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.408 ' O ' ' N ' ' A' ' 98' ' ' GLY . 0.0 OUTLIER -177.24 166.32 2.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.192 179.899 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -158.9 178.76 9.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.9 -179.817 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . 0.437 ' O ' ' N ' ' A' ' 69' ' ' LYS . 44.8 t80 -131.49 85.04 2.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.883 179.985 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . 0.51 ' O ' ' N ' ' A' ' 72' ' ' GLY . 10.1 p-10 -53.65 86.83 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.964 179.994 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 69' ' ' LYS . . . . . 0.437 ' N ' ' O ' ' A' ' 67' ' ' PHE . 0.1 OUTLIER -40.32 -46.95 2.43 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.914 179.933 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . 0.411 ' C ' ' O ' ' A' ' 69' ' ' LYS . 8.7 m-30 -36.59 -74.94 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.954 179.928 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -93.79 -41.38 9.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.019 -179.976 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 72' ' ' GLY . . . . . 0.51 ' N ' ' O ' ' A' ' 68' ' ' ASP . . . 108.02 -3.44 33.61 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.661 -0.781 . . . . 0.0 112.468 -179.994 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . 0.492 ' N ' ' OD1' ' A' ' 73' ' ' ASN . 0.3 OUTLIER -73.21 102.57 3.67 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.836 0.351 . . . . 0.0 110.848 -179.982 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 74' ' ' THR . . . . . 0.403 HG23 ' N ' ' A' ' 75' ' ' TYR . 93.1 m -41.69 134.39 2.48 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.081 179.941 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 75' ' ' TYR . . . . . 0.403 ' N ' HG23 ' A' ' 74' ' ' THR . 14.3 m-85 -122.76 -174.26 2.88 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.739 179.959 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -117.7 149.46 40.7 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.804 179.94 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.436 ' CG1' ' HG2' ' A' ' 64' ' ' GLU . 9.6 p -63.08 -28.73 45.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.085 -179.991 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -91.69 11.13 72.99 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.518 179.872 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -126.07 153.9 43.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.836 0.351 . . . . 0.0 110.897 179.99 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -127.07 167.68 15.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.152 -179.883 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 81' ' ' TYR . . . . . 0.411 ' N ' ' CD1' ' A' ' 81' ' ' TYR . 0.5 OUTLIER -149.56 154.1 38.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.885 -179.98 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -102.4 164.59 11.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.941 179.959 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 169.95 121.96 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.769 -179.998 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 84' ' ' PRO . . . . . 0.435 ' HA ' ' HA ' ' A' ' 89' ' ' ILE . 45.4 Cg_endo -68.45 161.49 44.7 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.73 2.287 . . . . 0.0 112.421 -179.962 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.432 ' O ' ' NE1' ' A' ' 90' ' ' TRP . 11.4 tptt 173.86 161.98 0.17 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.897 179.973 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 86' ' ' ASP . . . . . 0.489 ' O ' ' CB ' ' A' ' 87' ' ' SER . 1.1 m-20 56.81 19.97 4.84 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.934 -179.98 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 87' ' ' SER . . . . . 0.489 ' CB ' ' O ' ' A' ' 86' ' ' ASP . 1.4 t 82.16 18.61 0.35 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.876 -179.993 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 88' ' ' MET . . . . . 0.414 ' O ' ' O ' ' A' ' 85' ' ' LYS . 5.6 ttm -162.2 172.68 15.39 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.958 -179.941 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 89' ' ' ILE . . . . . 0.507 ' C ' ' CD1' ' A' ' 90' ' ' TRP . 2.8 mt -96.75 141.85 14.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.054 179.912 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 90' ' ' TRP . . . . . 0.573 ' CE3' ' HB ' ' A' ' 106' ' ' ILE . 0.5 OUTLIER -142.89 84.61 1.85 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.84 -179.985 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -38.88 92.23 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.715 -179.935 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 92' ' ' CYS . . . . . 0.505 ' N ' ' O ' ' A' ' 90' ' ' TRP . 0.1 OUTLIER -81.73 129.29 34.67 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.013 -179.955 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 93' ' ' THR . . . . . 0.456 ' O ' HG13 ' A' ' 95' ' ' ILE . 63.3 m -114.8 135.66 53.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.086 179.905 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 6.7 t -59.6 88.67 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.097 -179.91 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 95' ' ' ILE . . . . . 0.456 HG13 ' O ' ' A' ' 93' ' ' THR . 1.3 mt -109.34 87.93 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.282 -179.874 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -176.76 -39.71 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.848 -0.692 . . . . 0.0 112.515 179.942 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 97' ' ' ALA . . . . . 0.441 ' O ' ' O ' ' A' ' 63' ' ' GLU . . . 62.68 35.04 14.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.842 0.353 . . . . 0.0 111.205 179.932 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 98' ' ' GLY . . . . . 0.452 ' O ' ' HD3' ' A' ' 99' ' ' ARG . . . 140.42 -10.52 2.97 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.59 -0.814 . . . . 0.0 112.677 179.952 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 99' ' ' ARG . . . . . 0.452 ' HD3' ' O ' ' A' ' 98' ' ' GLY . 0.2 OUTLIER 176.49 -83.29 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.805 0.336 . . . . 0.0 110.793 -179.899 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . 0.469 ' O ' ' HB3' ' A' ' 101' ' ' ARG . . . 35.54 -108.32 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.546 179.965 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 101' ' ' ARG . . . . . 0.564 ' CD ' ' N ' ' A' ' 101' ' ' ARG . 0.0 OUTLIER 176.95 104.59 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.841 0.353 . . . . 0.0 110.92 179.983 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 2.7 mp -52.2 116.42 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.222 179.986 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 103' ' ' SER . . . . . 0.463 ' O ' ' HA ' ' A' ' 92' ' ' CYS . 3.8 t -82.26 139.74 34.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.771 179.911 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -114.91 113.41 24.14 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.997 -179.875 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 1.4 p -97.02 109.4 22.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.048 179.809 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 106' ' ' ILE . . . . . 0.573 ' HB ' ' CE3' ' A' ' 90' ' ' TRP . 0.0 OUTLIER -58.53 150.29 4.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.338 -179.927 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 107' ' ' ALA . . . . . 0.519 ' N ' HD11 ' A' ' 106' ' ' ILE . . . -99.98 126.84 46.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.946 179.822 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 -109.22 -13.25 14.68 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.036 -179.901 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.214 -0.898 . . . . 0.0 110.794 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 120.764 0.316 . . . . 0.0 111.154 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -171.89 131.26 0.72 Allowed Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.965 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -74.19 -165.48 0.27 Allowed 'Trans proline' 0 C--O 1.231 0.15 0 C-N-CA 122.818 2.345 . . . . 0.0 112.432 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 119.11 177.17 16.48 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.513 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -143.1 107.19 4.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.821 0.343 . . . . 0.0 111.046 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -96.37 118.16 32.34 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.691 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.4 ' OD2' ' CD ' ' A' ' 36' ' ' ARG . 0.2 OUTLIER -149.52 149.69 31.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.963 -179.944 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 39.8 t30 47.14 30.12 1.3 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.95 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 71.36 16.87 75.7 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.546 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.44 ' HB3' ' CZ ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -115.14 155.74 26.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.821 0.343 . . . . 0.0 110.823 -179.991 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 18.6 t-80 -111.38 83.97 1.86 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.151 -179.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.44 ' CZ ' ' HB3' ' A' ' 26' ' ' LYS . 0.9 OUTLIER -82.6 173.68 11.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.784 179.746 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.524 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 1.0 OUTLIER -109.74 140.92 43.07 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.596 179.709 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.503 ' CG2' ' HA2' ' A' ' 49' ' ' GLY . 4.0 mp -36.47 151.62 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.207 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.446 ' HB2' ' O ' ' A' ' 30' ' ' ILE . 29.7 m-80 66.53 13.22 9.19 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.789 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.524 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 13.4 tt0 -100.46 149.16 23.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.844 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.454 ' HG2' ' OG1' ' A' ' 46' ' ' THR . 10.9 mt-30 -115.99 143.93 44.77 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.178 -179.715 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . 0.571 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 37.6 p90 -145.69 162.43 37.57 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.6 179.616 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -100.0 128.19 46.11 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.979 0.419 . . . . 0.0 111.439 -179.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.4 ' CD ' ' OD2' ' A' ' 23' ' ' ASP . 0.0 OUTLIER -132.2 -163.26 1.31 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.278 179.527 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.467 ' HA ' ' O ' ' A' ' 41' ' ' ASN . 1.2 t -147.46 134.73 20.6 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.822 0.344 . . . . 0.0 111.244 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.523 ' HB2' ' CD2' ' A' ' 43' ' ' LEU . 0.3 OUTLIER -90.02 89.67 7.8 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.486 179.71 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.499 ' CB ' ' O ' ' A' ' 38' ' ' TYR . 1.4 tp 82.89 -48.42 0.16 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.721 -179.729 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . 0.436 ' O ' ' ND2' ' A' ' 41' ' ' ASN . . . 178.53 34.9 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.867 -0.683 . . . . 0.0 112.557 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.467 ' O ' ' HA ' ' A' ' 37' ' ' THR . 25.1 m120 -148.18 148.59 30.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.659 0.266 . . . . 0.0 110.934 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.434 ' C ' ' O ' ' A' ' 41' ' ' ASN . . . -36.53 141.96 0.1 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.695 179.737 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.523 ' CD2' ' HB2' ' A' ' 38' ' ' TYR . 21.9 tp -169.92 99.38 0.3 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.85 0.357 . . . . 0.0 111.27 -179.567 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.509 ' N ' ' O ' ' A' ' 57' ' ' GLU . 24.8 t -75.92 159.53 5.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.569 179.492 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.571 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 0.0 OUTLIER -140.77 144.91 35.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.856 0.36 . . . . 0.0 111.266 -179.769 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.454 ' OG1' ' HG2' ' A' ' 33' ' ' GLN . 86.1 m -129.66 123.48 31.31 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.915 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.464 ' SG ' ' HA ' ' A' ' 30' ' ' ILE . 30.3 t -80.63 137.61 36.36 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.002 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.437 ' CE1' ' O ' ' A' ' 46' ' ' THR . 5.5 m-85 -117.05 -2.27 11.75 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.975 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.503 ' HA2' ' CG2' ' A' ' 30' ' ' ILE . . . 135.02 -173.62 21.51 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.438 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -85.13 -11.12 76.79 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.485 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -109.49 -44.32 3.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.819 0.342 . . . . 0.0 110.954 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 3.9 mtt180 -73.38 -29.39 62.59 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.049 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 75.26 -156.45 48.68 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.549 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.534 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 12.1 p90 -134.07 150.0 51.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.889 0.376 . . . . 0.0 110.952 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -120.46 104.39 9.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.839 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.467 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 1.2 m -67.48 163.78 20.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.936 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.509 ' O ' ' N ' ' A' ' 44' ' ' VAL . 0.2 OUTLIER -166.6 142.34 4.53 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.862 179.889 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.426 ' O ' ' C ' ' A' ' 59' ' ' LYS . 3.4 m -69.38 146.49 52.05 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.879 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.426 ' C ' ' O ' ' A' ' 58' ' ' SER . 0.9 OUTLIER -36.55 103.05 0.24 Allowed Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.871 179.947 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -49.82 145.2 18.81 Favored 'Trans proline' 0 N--CA 1.465 -0.169 0 C-N-CA 122.844 2.363 . . . . 0.0 112.482 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.44 ' O ' ' O ' ' A' ' 62' ' ' ALA . 44.9 tt0 -157.45 57.39 0.5 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.747 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.44 ' O ' ' O ' ' A' ' 61' ' ' GLU . . . 50.85 105.67 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.075 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.509 ' O ' ' CB ' ' A' ' 64' ' ' GLU . 3.0 tt0 -108.57 112.45 24.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.572 -179.859 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.509 ' CB ' ' O ' ' A' ' 63' ' ' GLU . 3.6 mt-10 159.37 63.05 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.078 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.434 HG21 ' O ' ' A' ' 64' ' ' GLU . 0.1 OUTLIER 170.66 154.54 0.06 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.13 179.958 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 17.8 m -126.07 -154.55 0.63 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.835 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.406 ' O ' ' N ' ' A' ' 73' ' ' ASN . 44.6 t80 -158.3 -40.31 0.06 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.024 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . 0.515 ' O ' ' N ' ' A' ' 72' ' ' GLY . 3.7 t0 71.01 70.07 0.18 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.968 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -43.05 -29.41 0.35 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.915 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . 0.561 ' CE2' ' HE3' ' A' ' 85' ' ' LYS . 7.5 m-30 -53.28 -54.18 40.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.947 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 25.4 m -119.97 -36.5 3.26 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.072 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . 0.515 ' N ' ' O ' ' A' ' 68' ' ' ASP . . . 97.79 47.71 2.06 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.439 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . 0.473 ' HB3' ' CZ ' ' A' ' 75' ' ' TYR . 0.4 OUTLIER -96.77 -172.56 2.5 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.787 0.327 . . . . 0.0 110.844 -179.979 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.491 ' O ' ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -120.78 117.99 28.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.016 179.913 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.491 ' CD1' ' O ' ' A' ' 74' ' ' THR . 9.6 m-85 -136.87 144.75 43.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.906 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -83.53 165.19 19.31 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.961 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.454 HG11 ' HA ' ' A' ' 64' ' ' GLU . 13.5 p -81.11 -18.46 11.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.169 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -100.92 42.96 1.82 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.509 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -164.21 133.1 3.7 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.813 0.34 . . . . 0.0 110.964 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 58.2 p -93.6 163.72 13.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.187 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 33.2 p90 -160.65 110.7 1.75 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.856 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -55.5 160.5 2.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.021 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.403 ' HA ' ' HD2' ' A' ' 84' ' ' PRO . 0.0 OUTLIER -148.91 96.59 3.75 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.8 179.888 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.403 ' HD2' ' HA ' ' A' ' 83' ' ' ARG . 36.8 Cg_endo -65.79 114.91 3.14 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.769 2.312 . . . . 0.0 112.333 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.561 ' HE3' ' CE2' ' A' ' 70' ' ' TYR . 0.5 OUTLIER -141.67 111.14 6.46 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.839 -179.978 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.454 ' CB ' ' O ' ' A' ' 85' ' ' LYS . 0.9 OUTLIER 80.65 -159.16 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.768 -179.963 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' SER . . . . . 0.445 ' O ' ' OG ' ' A' ' 87' ' ' SER . 2.3 t -89.85 17.32 6.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.919 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' MET . . . . . 0.563 ' HG2' ' CZ2' ' A' ' 90' ' ' TRP . 16.5 tpp -131.61 129.74 41.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.829 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -92.03 139.29 18.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.177 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . 0.563 ' CZ2' ' HG2' ' A' ' 88' ' ' MET . 1.7 m95 -136.4 152.21 50.37 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.823 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -104.89 87.65 2.71 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.842 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 73.2 m -67.26 140.71 57.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.013 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.503 ' O ' ' N ' ' A' ' 95' ' ' ILE . 86.6 m -123.94 122.53 38.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.127 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . 0.425 ' SG ' ' HB2' ' A' ' 75' ' ' TYR . 0.0 OUTLIER -63.08 69.65 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.798 -179.993 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.503 ' N ' ' O ' ' A' ' 93' ' ' THR . 1.2 mt -89.64 46.89 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.353 -179.845 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.446 ' HA2' ' HA2' ' A' ' 100' ' ' GLY . . . -52.4 -81.59 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.484 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.411 ' HA ' ' HG3' ' A' ' 63' ' ' GLU . . . 61.38 -89.05 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.811 0.338 . . . . 0.0 111.098 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -71.11 -30.59 67.39 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.488 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 9.1 ttt180 -174.87 -67.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.846 0.355 . . . . 0.0 110.923 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . 0.446 ' HA2' ' HA2' ' A' ' 96' ' ' GLY . . . -167.84 91.05 0.1 OUTLIER Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.486 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 4.5 ttt85 -109.25 42.28 1.48 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.808 0.337 . . . . 0.0 110.971 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 1.2 mp -52.55 95.9 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.193 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 47.5 t -86.48 123.53 31.8 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.913 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 46.2 m -116.02 101.03 8.38 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.844 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' THR . . . . . 0.43 HG23 ' O ' ' A' ' 105' ' ' THR . 14.0 t -110.98 142.14 43.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.133 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.527 HD11 ' CZ3' ' A' ' 90' ' ' TRP . 4.6 mp -44.26 149.05 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.987 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -49.09 139.9 10.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.881 0.372 . . . . 0.0 111.104 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -68.23 -33.28 74.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.897 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.228 -0.891 . . . . 0.0 110.938 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.448 ' OG ' ' HD2' ' A' ' 18' ' ' LYS . 3.8 p . . . . . 0 N--CA 1.485 1.321 0 CA-C-O 120.846 0.355 . . . . 0.0 111.252 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.448 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 0.0 OUTLIER 55.21 89.76 0.1 OUTLIER Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.895 179.99 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_exo -56.24 -163.87 0.02 OUTLIER 'Trans proline' 0 C--O 1.231 0.137 0 C-N-CA 122.753 2.302 . . . . 0.0 112.262 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.37 162.82 3.28 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.665 -0.779 . . . . 0.0 112.474 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 25.0 m -127.4 106.85 9.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.87 0.367 . . . . 0.0 110.846 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 32.6 t80 -86.25 120.87 28.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.985 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.452 ' OD1' ' CB ' ' A' ' 26' ' ' LYS . 3.6 p-10 -97.42 -160.29 0.79 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.866 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.429 ' C ' ' O ' ' A' ' 23' ' ' ASP . 0.4 OUTLIER -34.96 -75.67 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.976 -0.557 . . . . 0.0 111.008 -179.983 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -133.64 33.78 2.51 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.632 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.513 ' HB3' ' CE2' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -140.16 141.17 36.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.836 0.351 . . . . 0.0 110.969 -179.997 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 10.4 t-160 -120.44 90.14 3.27 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.968 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.625 ' CE2' ' CB ' ' A' ' 34' ' ' TRP . 93.1 m-85 -87.26 161.64 17.88 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.094 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.532 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 3.6 tt0 -87.56 156.38 19.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.803 179.829 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.508 ' CG2' ' HA3' ' A' ' 49' ' ' GLY . 3.9 mp -44.45 147.73 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.437 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 24.0 m-80 65.03 13.43 8.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.162 179.704 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.532 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 1.0 OUTLIER -99.74 148.6 24.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.879 0.371 . . . . 0.0 110.781 179.851 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.416 ' CG ' HG22 ' A' ' 46' ' ' THR . 25.6 mt-30 -115.96 151.0 36.25 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.913 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . 0.625 ' CB ' ' CE2' ' A' ' 28' ' ' TYR . 42.6 p90 -152.65 -174.45 4.92 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.902 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -114.61 132.45 56.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.019 -179.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.529 ' O ' ' CB ' ' A' ' 43' ' ' LEU . 3.1 ttt180 -139.22 165.92 25.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.725 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.401 ' OG1' ' C ' ' A' ' 41' ' ' ASN . 2.2 t -136.92 135.9 38.15 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.917 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.528 ' CD1' HD12 ' A' ' 39' ' ' LEU . 1.1 t80 -118.37 125.32 49.76 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.773 179.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.528 HD12 ' CD1' ' A' ' 38' ' ' TYR . 0.8 OUTLIER 65.36 14.42 9.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.605 -179.737 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 87.45 44.61 5.51 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.58 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.427 ' O ' ' C ' ' A' ' 42' ' ' ALA . 27.2 m-80 -144.09 125.5 14.8 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.751 0.31 . . . . 0.0 110.89 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.459 ' O ' ' CD1' ' A' ' 43' ' ' LEU . . . -35.04 147.57 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.945 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.529 ' CB ' ' O ' ' A' ' 36' ' ' ARG . 1.5 tp -165.49 157.78 15.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.988 0.423 . . . . 0.0 111.297 -179.686 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.465 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 3.6 t -126.2 135.46 63.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.335 179.382 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.573 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 0.5 OUTLIER -118.79 162.45 18.45 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.428 -179.486 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.416 HG22 ' CG ' ' A' ' 33' ' ' GLN . 20.5 m -147.69 131.14 16.68 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.895 179.799 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.477 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 14.3 t -91.35 132.26 36.3 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.882 0.372 . . . . 0.0 111.052 -179.85 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.459 ' HB2' ' HB3' ' A' ' 52' ' ' ARG . 2.0 m-85 -105.17 -35.96 7.42 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.783 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.508 ' HA3' ' CG2' ' A' ' 30' ' ' ILE . . . 76.63 173.08 36.63 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.489 -179.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . 0.52 ' O ' ' CB ' ' A' ' 51' ' ' SER . . . 66.91 18.0 68.15 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.64 -0.79 . . . . 0.0 112.532 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.52 ' CB ' ' O ' ' A' ' 50' ' ' GLY . 1.0 OUTLIER 85.78 -0.56 0.73 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.671 0.272 . . . . 0.0 111.208 179.964 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.465 ' HB2' ' O ' ' A' ' 49' ' ' GLY . 0.0 OUTLIER -56.87 -27.91 61.07 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.937 0.399 . . . . 0.0 110.882 179.942 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 74.45 129.5 0.19 Allowed Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.67 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.559 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 10.3 p90 -63.97 177.63 0.75 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.843 0.354 . . . . 0.0 110.825 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.515 ' ND2' ' O ' ' A' ' 54' ' ' PHE . 29.4 m120 -152.01 123.92 8.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.929 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.465 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.8 OUTLIER -104.56 155.88 18.45 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.908 179.951 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -170.5 171.75 6.31 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.019 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -57.28 136.44 56.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.932 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.456 ' O ' ' O ' ' A' ' 60' ' ' PRO . 2.3 tppp? -39.55 136.7 1.12 Allowed Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.054 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.456 ' O ' ' O ' ' A' ' 59' ' ' LYS . 76.4 Cg_exo -49.23 -169.1 0.0 OUTLIER 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.858 2.372 . . . . 0.0 112.36 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -74.58 -59.09 2.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.973 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.422 ' HB2' ' OG1' ' A' ' 65' ' ' THR . . . -150.73 130.33 13.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.113 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -95.45 -31.79 13.2 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.499 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.49 ' HG3' ' CG2' ' A' ' 77' ' ' VAL . 23.2 tt0 -95.85 57.03 1.78 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.904 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.422 ' OG1' ' HB2' ' A' ' 62' ' ' ALA . 22.4 p -157.06 -174.97 5.17 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.194 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -144.7 -165.19 2.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.844 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 86.9 t80 -163.83 97.94 0.86 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.819 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . 0.486 ' O ' ' N ' ' A' ' 72' ' ' GLY . 3.9 m-20 -72.26 83.57 1.04 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.962 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -39.41 -30.25 0.06 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.882 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 39.0 m-85 -57.45 -61.69 2.31 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.948 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 24.9 p -112.09 19.51 17.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.105 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . 0.486 ' N ' ' O ' ' A' ' 68' ' ' ASP . . . 38.69 54.96 2.24 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.547 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -124.22 160.19 28.46 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.835 0.35 . . . . 0.0 110.702 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.52 155.81 17.64 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.19 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 25.5 m-85 -139.09 -172.09 3.25 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.836 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -104.83 155.75 18.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.939 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.49 ' CG2' ' HG3' ' A' ' 64' ' ' GLU . 2.5 t -90.63 25.73 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.071 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -138.44 17.85 3.29 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.62 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -142.04 136.71 30.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.819 0.342 . . . . 0.0 110.974 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 1.4 p -93.67 114.08 26.3 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.116 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.505 ' CD1' ' O ' ' A' ' 92' ' ' CYS . 42.5 p90 -102.93 136.47 42.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.883 -179.935 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 90.1 mt-10 -97.37 164.73 12.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.72 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.79 117.68 1.93 Allowed Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.912 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -70.86 103.42 1.34 Allowed 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.671 2.247 . . . . 0.0 112.299 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -134.28 161.65 34.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.986 -179.899 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 51.4 31.08 6.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.932 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 71.34 5.36 5.41 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.087 179.934 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -132.62 178.57 6.74 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.924 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.503 ' C ' ' CD1' ' A' ' 90' ' ' TRP . 1.1 mt -116.67 145.33 22.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.076 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . 0.631 ' CZ3' ' CD1' ' A' ' 106' ' ' ILE . 0.0 OUTLIER -144.65 128.56 17.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.908 179.972 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.473 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 3.9 p30 -66.88 95.07 0.35 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.744 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . 0.505 ' O ' ' CD1' ' A' ' 81' ' ' TYR . 64.5 m -79.21 96.17 5.83 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.805 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 2.6 m -74.83 148.45 40.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.017 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . 0.448 ' O ' HG11 ' A' ' 77' ' ' VAL . 0.1 OUTLIER -96.8 51.01 1.13 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.916 -179.923 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.422 HG22 HD13 ' A' ' 95' ' ' ILE . 1.8 mt -44.85 -40.56 2.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.104 -179.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.497 ' O ' ' CB ' ' A' ' 97' ' ' ALA . . . 44.37 -163.08 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.502 179.925 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.497 ' CB ' ' O ' ' A' ' 96' ' ' GLY . . . 83.7 94.84 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.798 0.332 . . . . 0.0 111.075 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 117.67 -62.3 0.42 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.493 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.67 34.59 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.797 0.332 . . . . 0.0 110.88 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . 0.434 ' HA2' ' HA2' ' A' ' 96' ' ' GLY . . . 55.16 79.68 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.556 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.518 ' O ' ' CG ' ' A' ' 101' ' ' ARG . 1.4 tmt_? -106.9 56.77 0.64 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.843 0.354 . . . . 0.0 110.862 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -50.3 139.74 4.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.288 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 12.1 t -115.84 129.69 56.53 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.745 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.432 ' HB3' ' HB2' ' A' ' 90' ' ' TRP . 8.9 m -118.58 143.38 46.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.002 -179.842 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' THR . . . . . 0.468 ' O ' ' HA ' ' A' ' 90' ' ' TRP . 0.3 OUTLIER -151.65 153.77 35.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.039 179.913 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.631 ' CD1' ' CZ3' ' A' ' 90' ' ' TRP . 2.8 mp -59.71 156.6 2.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.311 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.452 ' N ' ' CG2' ' A' ' 106' ' ' ILE . . . 46.51 -178.57 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.292 179.856 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -97.58 40.78 1.14 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.847 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.102 0 CA-C-O 118.299 -0.858 . . . . 0.0 110.91 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.442 ' O ' ' O ' ' A' ' 18' ' ' LYS . 4.4 m . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 120.762 0.315 . . . . 0.0 111.062 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.442 ' O ' ' O ' ' A' ' 17' ' ' SER . 4.5 mmtp 58.32 145.76 0.05 OUTLIER Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.759 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.454 ' HB2' HD11 ' A' ' 30' ' ' ILE . 41.6 Cg_endo -67.15 119.63 6.67 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.655 2.237 . . . . 0.0 112.348 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 154.5 -163.13 31.04 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.684 -0.769 . . . . 0.0 112.536 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 80.4 m -139.39 72.65 1.41 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.818 0.342 . . . . 0.0 110.893 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 30.8 t80 -52.5 117.96 3.25 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.815 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -164.86 150.26 9.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.885 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.435 ' O ' ' CG ' ' A' ' 24' ' ' ASN . 28.1 t-20 62.25 26.66 15.98 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.904 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 72.2 11.31 75.23 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.592 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.572 ' HB3' ' CE1' ' A' ' 28' ' ' TYR . 0.4 OUTLIER -122.12 151.59 40.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.814 0.34 . . . . 0.0 110.863 -179.923 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 5.1 t-160 -111.92 89.98 3.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.085 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.572 ' CE1' ' HB3' ' A' ' 26' ' ' LYS . 3.5 m-85 -79.62 171.02 15.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.028 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.529 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 0.9 OUTLIER -111.92 139.26 47.56 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.82 179.915 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.468 ' HA ' ' SG ' ' A' ' 47' ' ' CYS . 3.9 mp -35.0 140.38 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.534 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 13.5 m-20 72.62 8.75 5.65 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.15 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.529 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 56.1 tt0 -97.82 155.24 17.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.849 0.357 . . . . 0.0 111.057 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.517 ' CG ' HG23 ' A' ' 46' ' ' THR . 28.5 mt-30 -118.05 156.99 27.64 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.867 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . 0.57 ' CH2' ' N ' ' A' ' 47' ' ' CYS . 38.2 p90 -155.35 166.95 31.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.707 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -99.77 123.13 43.72 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.169 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.62 -163.91 0.92 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.609 179.754 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.468 ' HA ' ' O ' ' A' ' 41' ' ' ASN . 3.4 t -167.08 32.37 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.353 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.463 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 0.2 OUTLIER -40.33 143.87 0.27 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.847 179.905 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.463 ' HB2' ' O ' ' A' ' 38' ' ' TYR . 2.3 mm? 66.5 16.5 10.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.857 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 66.95 42.07 92.94 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.524 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.468 ' O ' ' HA ' ' A' ' 37' ' ' THR . 51.6 m-80 -152.23 132.11 13.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.596 0.236 . . . . 0.0 110.781 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.459 ' O ' HD13 ' A' ' 43' ' ' LEU . . . -31.01 135.1 0.06 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.458 -179.761 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.51 ' CD2' ' HB3' ' A' ' 56' ' ' CYS . 0.7 OUTLIER -153.86 174.66 14.3 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.13 -179.732 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.489 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.6 t -144.88 127.05 9.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.478 179.541 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.574 ' SG ' ' CD1' ' A' ' 54' ' ' PHE . 0.8 OUTLIER -117.72 163.41 16.52 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.383 -179.528 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.517 HG23 ' CG ' ' A' ' 33' ' ' GLN . 2.0 m -145.13 134.81 23.42 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.926 179.78 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.57 ' N ' ' CH2' ' A' ' 34' ' ' TRP . 14.0 t -82.58 135.13 35.15 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.928 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -110.62 -32.35 6.92 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.881 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 92.03 -166.95 30.16 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.519 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 42.0 -114.73 0.73 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.751 -0.737 . . . . 0.0 112.631 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -126.07 1.63 7.22 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.659 0.266 . . . . 0.0 111.208 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.503 ' HA ' ' NE ' ' A' ' 52' ' ' ARG . 0.1 OUTLIER -59.25 -38.39 79.95 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.785 0.326 . . . . 0.0 110.98 -179.923 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 70.59 141.34 0.19 Allowed Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.631 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.574 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 7.7 p90 -59.7 172.97 0.62 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.848 0.356 . . . . 0.0 110.807 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -156.06 108.35 2.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.762 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.51 ' HB3' ' CD2' ' A' ' 43' ' ' LEU . 2.1 m -75.5 172.18 12.98 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.032 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -141.28 -94.06 0.14 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.125 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.454 ' HA ' HD13 ' A' ' 43' ' ' LEU . 1.9 t 178.86 131.33 0.08 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.874 0.369 . . . . 0.0 110.917 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -82.0 114.27 49.4 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.792 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_exo -42.76 111.42 0.21 Allowed 'Trans proline' 0 N--CA 1.462 -0.336 0 C-N-CA 122.709 2.273 . . . . 0.0 112.369 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -117.54 22.42 12.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.919 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -161.5 -165.02 1.21 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.124 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -99.71 -29.23 12.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.57 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 72.77 -172.65 0.14 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.947 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.453 ' HA ' ' O ' ' A' ' 75' ' ' TYR . 24.4 p 48.83 -167.03 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.02 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.467 ' O ' ' HA ' ' A' ' 74' ' ' THR . 5.7 p 167.23 177.8 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.962 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 38.3 t80 -129.36 111.53 12.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.906 179.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -79.38 94.13 5.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.926 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.428 ' HB3' ' CD1' ' A' ' 70' ' ' TYR . 0.1 OUTLIER -51.87 173.91 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.749 179.925 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . 0.481 ' N ' ' CD1' ' A' ' 70' ' ' TYR . 0.8 OUTLIER 76.19 -54.58 0.6 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.815 -179.961 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -107.22 -17.57 14.12 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.108 179.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 54.07 72.72 0.5 Allowed Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.48 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -140.83 96.27 2.99 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.789 0.328 . . . . 0.0 110.838 -179.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.467 ' HA ' ' O ' ' A' ' 66' ' ' CYS . 85.0 m -50.74 135.99 22.69 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.033 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.453 ' O ' ' HA ' ' A' ' 65' ' ' THR . 21.9 m-85 -129.47 175.3 8.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.893 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.09 133.84 41.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.826 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.408 ' HA ' ' O ' ' A' ' 94' ' ' CYS . 7.1 p -46.4 -39.77 3.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.029 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -94.99 33.14 5.57 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.472 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -135.13 114.67 12.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.882 0.373 . . . . 0.0 110.955 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.449 HG21 HG21 ' A' ' 93' ' ' THR . 44.9 p -86.36 150.31 24.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.163 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.5 ' CE1' ' HB3' ' A' ' 92' ' ' CYS . 32.9 p90 -139.4 -178.6 5.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.808 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.412 ' OE2' ' OD1' ' A' ' 108' ' ' ASN . 1.9 mp0 -115.97 151.38 35.54 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.888 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 14.7 ttm180 -139.31 101.03 7.59 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.96 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -75.34 113.71 3.83 Favored 'Trans proline' 0 N--CA 1.464 -0.264 0 C-N-CA 122.798 2.332 . . . . 0.0 112.364 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.7 mtpp -157.34 161.95 39.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.924 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 50.06 25.5 1.73 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.871 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.2 t 72.98 8.11 5.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.041 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' MET . . . . . 0.447 ' O ' ' NE1' ' A' ' 90' ' ' TRP . 0.0 OUTLIER -138.57 134.02 33.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.955 179.991 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.54 ' C ' ' CD1' ' A' ' 90' ' ' TRP . 2.8 mp -85.3 157.97 3.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.058 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . 0.564 ' CZ3' HD11 ' A' ' 106' ' ' ILE . 4.5 m95 -148.89 107.95 3.89 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.95 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.507 ' N ' ' O ' ' A' ' 105' ' ' THR . 11.1 t70 -58.58 91.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.785 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . 0.5 ' HB3' ' CE1' ' A' ' 81' ' ' TYR . 0.8 OUTLIER -74.46 150.49 39.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.134 -179.939 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.52 ' O ' ' N ' ' A' ' 95' ' ' ILE . 41.7 m -127.49 108.1 10.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.993 179.875 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . 0.408 ' O ' ' HA ' ' A' ' 77' ' ' VAL . 20.3 t -53.85 82.35 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.948 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.52 ' N ' ' O ' ' A' ' 93' ' ' THR . 1.5 mt -77.89 -26.57 14.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.216 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.449 ' HA3' ' HA3' ' A' ' 100' ' ' GLY . . . -158.42 164.03 33.26 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.514 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.457 ' O ' ' N ' ' A' ' 99' ' ' ARG . . . -91.92 104.14 16.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.781 0.324 . . . . 0.0 111.098 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 36.95 30.7 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.479 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.457 ' N ' ' O ' ' A' ' 97' ' ' ALA . 0.4 OUTLIER -147.98 -46.14 0.16 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.783 0.325 . . . . 0.0 110.935 -179.962 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . 0.48 ' C ' ' CG ' ' A' ' 101' ' ' ARG . . . -65.08 -98.07 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.572 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.48 ' CG ' ' C ' ' A' ' 100' ' ' GLY . 0.0 OUTLIER 172.02 94.3 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.751 0.31 . . . . 0.0 110.95 -179.987 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . 0.415 HD12 HG22 ' A' ' 102' ' ' ILE . 43.0 mt -72.07 78.15 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.125 179.867 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.454 ' O ' ' HA ' ' A' ' 92' ' ' CYS . 1.4 t -54.93 151.06 9.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.078 -179.915 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.459 ' SG ' ' HB2' ' A' ' 90' ' ' TRP . 0.0 OUTLIER -130.31 150.99 51.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.75 179.924 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' THR . . . . . 0.507 ' O ' ' N ' ' A' ' 91' ' ' ASP . 0.2 OUTLIER -167.28 134.2 2.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.916 0.389 . . . . 0.0 111.356 -179.947 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.564 HD11 ' CZ3' ' A' ' 90' ' ' TRP . 1.2 mp -66.57 165.25 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.118 179.863 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . 68.61 120.08 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.142 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . 0.412 ' OD1' ' OE2' ' A' ' 82' ' ' GLU . 0.1 OUTLIER -88.73 76.45 8.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.943 -179.979 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . 0.406 ' OXT' ' HG2' ' A' ' 109' ' ' ARG . 20.0 ttt85 . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.293 -0.861 . . . . 0.0 110.879 179.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.486 1.343 0 CA-C-O 120.784 0.326 . . . . 0.0 111.237 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.6 mptt -41.94 146.24 0.64 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.895 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_exo -46.24 110.85 0.3 Allowed 'Trans proline' 0 N--CA 1.465 -0.191 0 C-N-CA 122.713 2.276 . . . . 0.0 112.419 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 137.02 163.29 9.68 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.464 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.3 m -112.14 135.19 53.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.826 0.346 . . . . 0.0 110.914 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -115.09 115.68 27.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.85 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -160.21 159.92 32.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.853 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.512 ' O ' ' ND2' ' A' ' 24' ' ' ASN . 12.4 t30 58.8 25.19 13.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.9 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 72.89 7.27 69.83 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.443 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.48 ' HB3' ' CZ ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -122.91 142.3 50.95 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.756 0.312 . . . . 0.0 111.004 179.963 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 2.9 t-160 -114.49 88.28 2.82 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.862 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.48 ' CZ ' ' HB3' ' A' ' 26' ' ' LYS . 0.5 OUTLIER -79.63 -170.28 2.3 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.939 -179.939 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.47 ' O ' ' HB2' ' A' ' 32' ' ' GLN . 0.0 OUTLIER -102.12 173.24 6.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.953 -179.962 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.442 ' HA ' ' SG ' ' A' ' 47' ' ' CYS . 2.9 mp -66.4 155.63 7.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.469 -179.777 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 85.7 m-20 53.78 18.02 1.44 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.202 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.47 ' HB2' ' O ' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -95.29 151.46 19.23 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.668 179.823 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 -115.8 144.77 43.53 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.101 -179.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . 0.526 ' CZ3' ' HB2' ' A' ' 47' ' ' CYS . 41.2 p90 -148.9 178.78 8.38 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.753 179.663 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -103.11 129.87 50.1 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.025 0.441 . . . . 0.0 111.28 -179.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.528 ' O ' ' N ' ' A' ' 43' ' ' LEU . 32.5 ttt-85 -132.99 170.66 15.04 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.296 179.558 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.454 ' HA ' ' HB2' ' A' ' 43' ' ' LEU . 1.2 t -139.46 132.78 29.99 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.872 0.368 . . . . 0.0 111.477 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.452 ' CB ' HD22 ' A' ' 43' ' ' LEU . 45.9 t80 -124.05 124.21 42.04 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.655 179.793 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 70.33 22.37 5.39 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.989 0.424 . . . . 0.0 110.478 -179.711 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 76.4 41.06 26.53 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.923 -0.656 . . . . 0.0 112.501 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 -145.46 138.08 25.92 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.819 0.342 . . . . 0.0 111.254 179.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.469 ' O ' HD12 ' A' ' 43' ' ' LEU . . . -37.75 152.31 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.876 179.827 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.528 ' N ' ' O ' ' A' ' 36' ' ' ARG . 2.2 tp -167.28 159.62 12.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.22 -179.839 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.488 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.6 t -130.24 129.11 64.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.661 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.567 ' SG ' ' CD1' ' A' ' 54' ' ' PHE . 0.8 OUTLIER -110.75 163.53 13.68 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.32 -179.715 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 35.4 m -144.78 118.41 9.17 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.031 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.526 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 35.2 t -72.71 145.62 47.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.018 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.491 ' CB ' ' HB3' ' A' ' 52' ' ' ARG . 4.9 m-85 -119.39 -16.3 8.98 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.921 179.939 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.417 ' O ' ' C ' ' A' ' 50' ' ' GLY . . . 92.57 179.95 40.5 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.505 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . 0.417 ' C ' ' O ' ' A' ' 49' ' ' GLY . . . 36.13 -107.8 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.482 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 28.4 t -131.67 7.79 4.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.776 0.322 . . . . 0.0 111.05 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.491 ' HB3' ' CB ' ' A' ' 48' ' ' TYR . 7.3 mmt180 -52.66 -19.77 2.61 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.966 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 68.62 151.59 0.38 Allowed Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.355 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.567 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 4.3 p90 -92.96 157.95 16.06 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.834 0.35 . . . . 0.0 110.945 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -116.87 115.6 25.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.623 179.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.488 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.1 OUTLIER -102.93 152.81 20.87 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.203 -179.778 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -175.26 179.49 1.51 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.814 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 26.7 t -73.9 135.14 43.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.925 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 3.9 tptp -39.88 111.55 0.73 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.931 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -69.61 156.3 64.13 Favored 'Trans proline' 0 C--O 1.232 0.195 0 C-N-CA 122.665 2.243 . . . . 0.0 112.293 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -81.38 -50.14 9.84 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.906 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -156.93 148.21 22.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.062 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.459 ' OE2' ' HB2' ' A' ' 97' ' ' ALA . 1.4 tt0 -103.7 -38.93 6.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.468 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.01 -176.38 2.07 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.91 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.5 p 64.85 -162.27 0.27 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.198 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.463 ' O ' ' HA ' ' A' ' 74' ' ' THR . 29.0 m -160.19 157.6 28.58 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.857 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.429 ' O ' ' C ' ' A' ' 68' ' ' ASP . 71.2 t80 -110.14 -17.65 13.5 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.67 179.776 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . 0.443 ' OD2' ' CE2' ' A' ' 81' ' ' TYR . 4.3 t0 35.52 93.56 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.027 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.577 ' O ' ' CD2' ' A' ' 70' ' ' TYR . 4.0 ptmt -52.87 -170.13 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.624 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . 0.577 ' CD2' ' O ' ' A' ' 69' ' ' LYS . 8.1 m-85 83.87 -56.4 0.14 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.837 0.351 . . . . 0.0 110.922 -179.829 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -134.45 17.55 3.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.159 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 45.14 58.68 4.92 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.391 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -89.61 164.86 14.57 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.811 0.339 . . . . 0.0 110.894 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.463 ' HA ' ' O ' ' A' ' 66' ' ' CYS . 0.9 OUTLIER -118.29 90.19 3.28 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.134 179.905 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 16.6 m-30 -97.94 -168.85 1.73 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.861 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.94 162.49 30.54 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.763 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 3.4 t -76.58 -22.92 15.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.134 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -92.18 15.04 63.01 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.566 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -151.53 113.73 4.54 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.771 0.319 . . . . 0.0 110.815 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.52 ' HB ' ' CG2' ' A' ' 93' ' ' THR . 1.3 t -74.18 179.43 4.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.12 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.509 ' N ' ' OG1' ' A' ' 80' ' ' THR . 45.7 p90 -153.71 168.26 26.84 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.931 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -110.64 144.21 39.89 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.706 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.04 96.02 4.35 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.0 -179.888 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_exo -56.22 138.88 84.8 Favored 'Trans proline' 0 N--CA 1.466 -0.134 0 C-N-CA 122.836 2.357 . . . . 0.0 112.044 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.428 ' O ' ' N ' ' A' ' 87' ' ' SER . 0.2 OUTLIER -155.39 165.11 37.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.917 0.389 . . . . 0.0 111.095 -179.932 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 46.76 -92.7 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.024 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' SER . . . . . 0.428 ' N ' ' O ' ' A' ' 85' ' ' LYS . 0.8 OUTLIER -152.16 18.37 0.66 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.969 -179.964 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' MET . . . . . 0.4 ' CE ' ' HA ' ' A' ' 88' ' ' MET . 0.6 OUTLIER -147.1 167.45 24.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.878 -179.995 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.411 ' O ' ' N ' ' A' ' 107' ' ' ALA . 4.0 mt -107.39 140.34 26.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.063 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . 0.533 ' N ' ' CD1' ' A' ' 90' ' ' TRP . 0.7 OUTLIER -131.86 124.5 29.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.953 -179.868 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -67.1 72.08 0.1 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.742 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . 0.469 ' HA ' ' O ' ' A' ' 103' ' ' SER . 54.3 m -59.89 111.83 1.62 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.024 -179.845 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.52 ' CG2' ' HB ' ' A' ' 80' ' ' THR . 32.2 m -103.79 119.74 39.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.98 179.803 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . 0.45 ' SG ' HD11 ' A' ' 102' ' ' ILE . 0.0 OUTLIER -58.53 80.53 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.832 -179.907 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.467 ' N ' ' O ' ' A' ' 93' ' ' THR . 2.1 mt -98.87 101.05 11.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.312 -179.84 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 144.66 176.19 18.45 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.5 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.459 ' HB2' ' OE2' ' A' ' 63' ' ' GLU . . . -69.23 58.82 0.11 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.837 0.351 . . . . 0.0 111.087 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.43 -23.47 15.53 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.559 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -176.58 55.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.846 0.355 . . . . 0.0 110.961 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -89.75 -37.16 6.99 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.39 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.517 ' O ' ' N ' ' A' ' 103' ' ' SER . 2.3 ptp85 -178.58 49.33 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.842 0.353 . . . . 0.0 110.74 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . 0.45 HD11 ' SG ' ' A' ' 94' ' ' CYS . 10.4 mm -38.39 90.48 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.262 -179.903 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.517 ' N ' ' O ' ' A' ' 101' ' ' ARG . 21.9 t -69.08 174.2 4.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.603 179.777 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.443 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 20.1 m -155.76 124.35 5.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.032 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 2.9 p -92.89 104.67 16.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.108 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.515 HG13 ' CZ3' ' A' ' 90' ' ' TRP . 1.3 tt -43.99 151.0 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.083 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.411 ' N ' ' O ' ' A' ' 89' ' ' ILE . . . -121.91 126.25 48.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.063 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 22.1 p30 -147.49 173.14 12.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.888 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.284 -0.865 . . . . 0.0 110.866 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 46.3 p . . . . . 0 N--CA 1.487 1.394 0 CA-C-O 120.81 0.338 . . . . 0.0 111.136 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.407 ' O ' ' O ' ' A' ' 19' ' ' PRO . 3.0 mtmt -115.03 90.93 24.94 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.899 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.407 ' O ' ' O ' ' A' ' 18' ' ' LYS . 69.2 Cg_exo -50.84 -169.08 0.0 OUTLIER 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.739 2.293 . . . . 0.0 112.303 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.18 -167.82 45.91 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.454 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 54.5 m -126.79 132.42 51.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.842 0.353 . . . . 0.0 110.938 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 11.9 t80 -105.98 123.17 47.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.772 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -156.99 134.25 10.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.057 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.465 ' OD1' ' O ' ' A' ' 24' ' ' ASN . 29.8 t30 63.33 11.09 5.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.132 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 97.49 -13.19 64.5 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.8 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.77 146.44 24.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.784 0.326 . . . . 0.0 110.708 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 9.9 t-160 -118.21 90.89 3.43 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.264 -179.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -80.91 -165.82 0.99 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.822 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.52 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 0.5 OUTLIER -116.59 158.71 23.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.729 179.799 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.498 HG22 ' ND2' ' A' ' 31' ' ' ASN . 3.2 mp -51.98 152.54 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.303 -179.791 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.498 ' ND2' HG22 ' A' ' 30' ' ' ILE . 1.6 m-80 55.07 20.49 3.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.162 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.52 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 18.7 tt0 -101.28 152.08 21.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.759 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.416 ' HG2' ' OG1' ' A' ' 46' ' ' THR . 19.9 mt-30 -117.22 145.11 44.11 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.021 -179.836 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . 0.578 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 38.2 p90 -146.89 177.56 9.03 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.736 179.771 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -107.78 133.33 52.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.285 -179.631 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.436 ' NE ' ' O ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -132.78 -168.83 2.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.449 179.569 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.46 ' HA ' ' HB2' ' A' ' 43' ' ' LEU . 1.1 t -158.48 145.4 17.57 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.886 0.374 . . . . 0.0 111.283 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -132.77 132.28 42.08 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.655 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 57.4 22.36 7.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.563 -179.727 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 81.88 42.69 8.74 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.859 -0.686 . . . . 0.0 112.558 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.443 ' O ' ' OG1' ' A' ' 37' ' ' THR . 83.9 m-20 -143.6 130.95 20.92 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 120.802 0.334 . . . . 0.0 111.137 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.522 ' O ' ' CD1' ' A' ' 43' ' ' LEU . . . -39.34 156.64 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.838 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.522 ' CD1' ' O ' ' A' ' 42' ' ' ALA . 1.4 tp -169.32 160.07 9.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.217 -179.905 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.485 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.9 t -127.29 128.77 70.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.625 179.624 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.578 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 0.8 OUTLIER -114.69 151.39 33.71 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.148 -179.719 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.416 ' OG1' ' HG2' ' A' ' 33' ' ' GLN . 29.3 m -135.61 133.75 38.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.054 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.5 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 28.4 t -85.7 160.86 19.44 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.813 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.495 ' CD1' ' O ' ' A' ' 53' ' ' GLY . 75.1 m-85 -133.36 -39.65 0.91 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.943 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.475 ' O ' ' N ' ' A' ' 51' ' ' SER . . . 154.74 45.52 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.5 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 64.52 -69.32 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.44 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.475 ' N ' ' O ' ' A' ' 49' ' ' GLY . 12.2 m -63.86 -48.06 78.25 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.805 0.336 . . . . 0.0 110.847 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.494 ' HB3' ' CB ' ' A' ' 48' ' ' TYR . 0.2 OUTLIER -56.63 -23.36 40.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.865 179.9 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . 0.495 ' O ' ' CD1' ' A' ' 48' ' ' TYR . . . 68.98 145.43 0.16 Allowed Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.594 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.569 ' CE1' ' SG ' ' A' ' 45' ' ' CYS . 13.1 p90 -86.73 170.05 12.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.872 0.368 . . . . 0.0 110.798 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.42 ' O ' ' HA ' ' A' ' 45' ' ' CYS . 5.0 m120 -141.0 138.28 33.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.728 179.857 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.485 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.5 OUTLIER -117.83 159.97 22.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.105 -179.846 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.443 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.6 pm0 -168.42 172.14 8.55 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.865 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.459 ' HA ' HD12 ' A' ' 43' ' ' LEU . 0.9 OUTLIER -76.5 152.27 36.14 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.872 -179.999 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -45.33 116.51 3.07 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.953 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -50.66 -23.31 10.9 Favored 'Trans proline' 0 C--O 1.231 0.159 0 C-N-CA 122.719 2.279 . . . . 0.0 112.344 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.459 ' O ' ' O ' ' A' ' 62' ' ' ALA . 0.7 OUTLIER -70.7 58.0 0.2 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.939 -179.993 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.459 ' O ' ' O ' ' A' ' 61' ' ' GLU . . . 42.21 -168.96 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.014 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -74.25 -27.37 60.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.483 179.751 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.465 ' HB3' HG12 ' A' ' 77' ' ' VAL . 1.6 mp0 -81.24 156.68 25.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.789 179.831 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.459 ' OG1' ' N ' ' A' ' 66' ' ' CYS . 2.6 t 175.37 177.97 0.17 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.996 0.427 . . . . 0.0 111.378 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.459 ' N ' ' OG1' ' A' ' 65' ' ' THR . 0.1 OUTLIER 175.11 -162.34 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.727 -179.989 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.466 ' HA ' ' O ' ' A' ' 73' ' ' ASN . 68.9 t80 -170.07 -38.73 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.045 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 4.6 t70 49.98 88.11 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.757 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.453 ' C ' ' CG ' ' A' ' 70' ' ' TYR . 1.8 mtmt -59.31 159.5 7.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.89 -179.876 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . 0.453 ' CG ' ' C ' ' A' ' 69' ' ' LYS . 1.0 OUTLIER 77.68 17.35 1.4 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.008 179.981 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 2.9 m -162.86 -44.93 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.234 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 77.0 75.33 0.92 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.581 -0.818 . . . . 0.0 112.49 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . 0.466 ' O ' ' HA ' ' A' ' 67' ' ' PHE . 3.0 m120 -129.42 -172.29 2.71 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.88 0.371 . . . . 0.0 110.808 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 1.3 m -146.8 100.85 3.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.022 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.41 ' N ' ' CD1' ' A' ' 75' ' ' TYR . 3.6 m-30 -92.85 -160.54 0.76 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.81 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . 0.456 ' O ' ' C ' ' A' ' 77' ' ' VAL . 0.4 OUTLIER -142.85 60.51 1.42 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.785 179.825 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.514 ' CG2' ' O ' ' A' ' 77' ' ' VAL . 6.6 p 29.32 44.71 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.62 179.807 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -160.41 41.55 0.44 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.508 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -160.75 109.06 1.6 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.775 0.321 . . . . 0.0 110.861 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 1.1 t -96.15 172.44 7.98 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.113 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 42.2 p90 -165.54 -174.04 2.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.829 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 -114.77 126.07 54.42 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.832 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 5.0 ttm180 -130.77 90.99 38.45 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.129 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -57.33 120.46 8.39 Favored 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.744 2.296 . . . . 0.0 112.061 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.6 tptp -126.08 146.26 50.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.013 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 60.74 -84.66 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.934 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.1 p -155.81 21.47 0.39 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.017 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 1.8 ttt -144.55 164.71 30.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.881 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.495 ' C ' ' CD1' ' A' ' 90' ' ' TRP . 2.2 mt -99.42 150.99 4.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.139 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . 0.57 ' CE3' ' HA ' ' A' ' 106' ' ' ILE . 4.5 m95 -147.08 120.72 9.15 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.867 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.441 ' OD1' ' N ' ' A' ' 91' ' ' ASP . 0.1 OUTLIER -70.82 58.49 0.21 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.985 -179.959 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . 0.406 ' HA ' ' HA ' ' A' ' 104' ' ' CYS . 84.5 m -45.4 136.24 5.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.871 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.43 HG22 ' N ' ' A' ' 94' ' ' CYS . 40.9 m -122.72 139.25 54.17 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.146 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . 0.43 ' N ' HG22 ' A' ' 93' ' ' THR . 30.8 t -69.95 68.2 0.29 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.848 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.458 HD12 HG21 ' A' ' 95' ' ' ILE . 2.6 mt -77.88 123.21 34.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.276 -179.846 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.514 ' O ' ' CB ' ' A' ' 97' ' ' ALA . . . -145.28 -151.52 5.43 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.515 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.514 ' CB ' ' O ' ' A' ' 96' ' ' GLY . . . 85.17 72.49 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.807 0.337 . . . . 0.0 111.136 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 92.04 -59.27 2.77 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.515 -179.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.454 ' O ' ' HD2' ' A' ' 101' ' ' ARG . 0.0 OUTLIER -163.82 56.96 0.17 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.865 0.364 . . . . 0.0 110.97 -179.966 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . 0.458 ' O ' ' O ' ' A' ' 101' ' ' ARG . . . -80.88 -40.1 12.48 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.435 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.458 ' O ' ' O ' ' A' ' 100' ' ' GLY . 0.0 OUTLIER 55.15 115.89 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.833 0.349 . . . . 0.0 110.863 -179.941 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . 0.451 HD13 ' SG ' ' A' ' 66' ' ' CYS . 2.2 mm -44.98 94.36 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.121 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.419 ' N ' ' O ' ' A' ' 101' ' ' ARG . 15.5 t -76.65 149.37 36.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.909 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.406 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 92.5 m -132.75 102.69 5.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.961 -179.946 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 14.8 t -84.81 143.0 29.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.061 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.57 ' HA ' ' CE3' ' A' ' 90' ' ' TRP . 7.3 tt -70.94 140.36 18.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.053 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -103.97 145.54 29.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.115 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -125.18 14.26 8.37 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.955 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 3.1 ttp180 . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.263 -0.875 . . . . 0.0 110.899 -179.95 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 58.4 p . . . . . 0 N--CA 1.485 1.323 0 CA-C-O 120.819 0.342 . . . . 0.0 111.232 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.401 ' HB2' ' HD2' ' A' ' 19' ' ' PRO . 0.0 OUTLIER -159.83 156.63 24.68 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.921 179.988 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.401 ' HD2' ' HB2' ' A' ' 18' ' ' LYS . 68.8 Cg_endo -74.45 -162.92 0.16 Allowed 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.785 2.323 . . . . 0.0 112.391 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.457 ' HA2' HG13 ' A' ' 30' ' ' ILE . . . 67.68 -143.64 42.41 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.526 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -159.68 52.41 0.35 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.861 0.362 . . . . 0.0 110.954 -179.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.586 ' N ' ' CD2' ' A' ' 27' ' ' HIS . 0.4 OUTLIER -47.88 102.78 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.886 -179.987 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -77.95 -167.24 0.95 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.846 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -43.07 -54.86 4.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.886 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -140.98 8.25 2.71 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.472 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.518 ' HB3' ' CE1' ' A' ' 28' ' ' TYR . 0.1 OUTLIER -127.94 131.47 49.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.79 0.328 . . . . 0.0 110.816 179.988 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . 0.586 ' CD2' ' N ' ' A' ' 22' ' ' TYR . 9.2 t-160 -117.52 88.67 2.96 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.034 -179.766 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.518 ' CE1' ' HB3' ' A' ' 26' ' ' LYS . 6.9 m-85 -79.68 161.71 25.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.888 179.864 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.532 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 4.0 mt-30 -84.73 137.4 33.24 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.618 179.721 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.525 HG21 ' CA ' ' A' ' 49' ' ' GLY . 3.9 mp -37.83 147.28 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 120.904 0.383 . . . . 0.0 111.189 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.462 ' HB2' ' O ' ' A' ' 30' ' ' ILE . 26.5 m-80 67.29 11.89 8.63 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.157 179.76 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.532 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 41.7 tt0 -100.33 144.55 29.2 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.785 0.326 . . . . 0.0 110.771 179.726 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 13.2 mt-30 -111.74 156.63 21.6 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.003 0.43 . . . . 0.0 111.278 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . 0.484 ' CZ3' ' HB2' ' A' ' 47' ' ' CYS . 48.3 p90 -163.06 162.67 25.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.641 179.836 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -106.5 124.86 50.23 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.938 0.399 . . . . 0.0 111.1 -179.725 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.485 ' N ' ' O ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -123.52 -169.95 2.03 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.595 179.642 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.3 t -150.26 131.49 14.53 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.161 179.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.474 ' CB ' HD23 ' A' ' 43' ' ' LEU . 20.2 t80 -121.77 139.85 53.08 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.506 179.752 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 55.88 20.03 3.91 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.943 0.401 . . . . 0.0 110.387 -179.701 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 78.52 46.21 9.02 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.944 -0.646 . . . . 0.0 112.617 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.425 ' O ' ' C ' ' A' ' 42' ' ' ALA . 35.6 m-80 -151.32 132.21 14.19 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.808 0.337 . . . . 0.0 110.969 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.425 ' C ' ' O ' ' A' ' 41' ' ' ASN . . . -36.04 147.59 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.982 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.485 ' O ' ' N ' ' A' ' 36' ' ' ARG . 1.8 tp -159.53 147.28 17.2 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.07 -179.842 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.493 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 3.2 t -122.21 131.56 72.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.6 179.7 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.57 ' SG ' ' CD1' ' A' ' 54' ' ' PHE . 0.8 OUTLIER -117.47 152.42 35.07 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.268 -179.678 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.455 ' O ' ' CE1' ' A' ' 48' ' ' TYR . 88.4 m -138.78 112.76 8.53 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.02 179.83 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.484 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 8.7 t -77.05 134.58 38.74 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.947 179.898 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.466 ' O ' ' CG2' ' A' ' 30' ' ' ILE . 2.0 m-85 -106.84 -45.34 4.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.926 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.525 ' CA ' HG21 ' A' ' 30' ' ' ILE . . . 117.89 -172.52 14.42 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.508 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 41.42 -112.11 0.35 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.571 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -110.64 -21.15 12.26 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.799 0.333 . . . . 0.0 111.017 -179.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 3.8 mtt180 -47.6 -29.84 3.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.824 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 64.6 -124.67 29.63 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.599 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.57 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 8.1 p90 -155.98 155.04 32.06 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.83 0.348 . . . . 0.0 110.864 -179.817 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -124.43 132.63 53.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.719 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.493 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.1 OUTLIER -112.42 160.96 17.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.114 -179.915 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 178.36 171.93 0.72 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.917 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 79.1 p -59.44 116.16 3.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.931 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.409 ' HD3' ' C ' ' A' ' 59' ' ' LYS . 0.0 OUTLIER -46.76 136.37 7.77 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.973 179.922 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -46.04 124.39 7.31 Favored 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.758 2.305 . . . . 0.0 112.427 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.17 -52.21 9.05 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.921 -179.866 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.4 ' HB3' ' CB ' ' A' ' 97' ' ' ALA . . . -165.28 133.81 3.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.152 -179.935 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -60.48 169.0 1.88 Allowed 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.146 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -106.06 79.23 1.38 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.806 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.495 ' OG1' ' N ' ' A' ' 66' ' ' CYS . 0.1 OUTLIER -168.9 174.41 6.46 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.185 -179.948 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.495 ' N ' ' OG1' ' A' ' 65' ' ' THR . 1.6 p 173.93 105.06 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.856 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 85.3 t80 -62.36 117.46 6.16 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.91 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . 0.473 ' O ' ' N ' ' A' ' 70' ' ' TYR . 6.1 t0 -89.14 78.87 7.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.865 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.417 ' C ' ' O ' ' A' ' 68' ' ' ASP . 9.4 pttp -36.08 -31.55 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.849 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . 0.473 ' N ' ' O ' ' A' ' 68' ' ' ASP . 5.2 m-85 -40.79 -56.16 2.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.965 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.421 HG21 ' ND2' ' A' ' 73' ' ' ASN . 12.8 t -126.8 -36.21 2.23 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.166 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 125.11 10.6 4.62 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.53 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . 0.464 ' O ' ' HB2' ' A' ' 68' ' ' ASP . 66.5 m-20 -97.06 140.25 31.85 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.827 0.346 . . . . 0.0 110.848 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 4.1 t -103.92 140.96 36.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.084 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -126.42 -178.62 4.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.797 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -78.48 124.73 28.46 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.87 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.413 ' HA ' ' O ' ' A' ' 94' ' ' CYS . 8.9 p -46.43 -42.68 5.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.175 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -86.85 38.34 3.13 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.496 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -123.34 139.52 53.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.814 0.34 . . . . 0.0 110.894 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 24.1 p -111.99 109.32 19.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.093 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.415 ' C ' ' OD1' ' A' ' 91' ' ' ASP . 6.4 p90 -121.04 143.34 49.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.834 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -85.15 175.08 9.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.928 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.419 ' HA ' ' HD2' ' A' ' 84' ' ' PRO . 0.0 OUTLIER -164.98 111.12 0.83 Allowed Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.792 179.952 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.419 ' HD2' ' HA ' ' A' ' 83' ' ' ARG . 25.0 Cg_endo -62.2 137.38 65.78 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.718 2.278 . . . . 0.0 112.277 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -171.77 132.41 0.72 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.901 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 54.71 -160.36 0.16 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.911 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.2 p -89.64 33.71 0.84 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.87 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' MET . . . . . 0.506 ' O ' ' NE1' ' A' ' 90' ' ' TRP . 2.6 ttm -162.71 129.54 3.57 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.823 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 1.3 mt -91.67 133.6 32.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.205 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . 0.595 ' N ' ' CD1' ' A' ' 90' ' ' TRP . 0.0 OUTLIER -127.5 123.44 35.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.912 179.891 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.415 ' OD1' ' C ' ' A' ' 81' ' ' TYR . 41.8 t0 -76.61 102.02 5.96 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.931 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . 0.488 ' HA ' ' HA ' ' A' ' 104' ' ' CYS . 1.1 m -81.21 117.48 21.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.01 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 30.3 m -88.33 127.64 35.48 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.018 179.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . 0.413 ' O ' ' HA ' ' A' ' 77' ' ' VAL . 0.1 OUTLIER -68.22 86.2 0.27 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.914 -179.919 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 1.2 mt -99.33 61.58 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.352 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -96.71 -114.27 3.07 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.549 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.4 ' CB ' ' HB3' ' A' ' 62' ' ' ALA . . . 68.08 20.75 8.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.95 0.405 . . . . 0.0 111.112 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 156.02 -52.58 0.43 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.722 -0.752 . . . . 0.0 112.327 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.438 ' CG ' ' O ' ' A' ' 99' ' ' ARG . 0.0 OUTLIER -133.12 94.12 3.3 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.826 0.346 . . . . 0.0 110.873 179.993 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -36.72 98.35 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.835 -0.698 . . . . 0.0 112.552 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -117.66 48.95 1.28 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.756 0.313 . . . . 0.0 110.813 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 2.2 mp -56.22 102.55 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.192 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 32.5 t -98.6 129.42 45.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.738 179.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.488 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 0.7 OUTLIER -99.53 148.41 24.3 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.97 0.414 . . . . 0.0 111.033 -179.888 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -157.05 112.48 2.85 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.061 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.588 ' CD1' ' CZ3' ' A' ' 90' ' ' TRP . 3.3 mp -40.3 131.95 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.173 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -96.27 108.56 21.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.083 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 3.8 p30 -132.08 36.21 3.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.906 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 9.2 mtp85 . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.945 -179.955 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 12.9 t . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.794 0.331 . . . . 0.0 111.22 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 9.3 mtmt 63.81 147.53 0.1 OUTLIER Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.992 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -65.8 173.55 6.74 Favored 'Trans proline' 0 C--O 1.231 0.163 0 C-N-CA 122.751 2.301 . . . . 0.0 112.275 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 95.4 177.76 37.18 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.384 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 69.6 m -112.58 126.58 55.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.81 0.338 . . . . 0.0 110.877 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 15.0 t80 -119.39 121.47 39.6 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.975 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.423 ' O ' ' C ' ' A' ' 24' ' ' ASN . 2.0 t0 -99.33 -162.5 0.96 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.942 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.423 ' C ' ' O ' ' A' ' 23' ' ' ASP . 7.9 t-20 -35.81 -53.14 0.73 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.954 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -153.64 20.76 0.7 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.588 -179.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.411 ' HB3' ' CE2' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -121.41 132.66 54.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.889 0.376 . . . . 0.0 110.952 179.868 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 13.5 t-160 -115.0 91.56 3.65 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.096 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.454 ' HB3' ' OE1' ' A' ' 32' ' ' GLN . 0.1 OUTLIER -83.15 -178.39 7.09 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.929 179.915 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.524 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 1.7 tt0 -114.21 152.41 31.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.548 179.636 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.451 ' HA ' ' SG ' ' A' ' 47' ' ' CYS . 3.4 mp -49.47 154.03 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.153 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 10.7 m-20 59.53 17.95 6.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.02 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.524 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 2.2 tt0 -105.25 142.54 34.84 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.81 179.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -115.93 140.71 48.97 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.05 -179.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . 0.584 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 39.6 p90 -148.5 -173.34 4.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.807 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 61.6 tt0 -120.01 121.67 39.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.925 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.447 ' O ' HD21 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -106.81 156.45 18.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.821 179.982 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.3 m -110.09 139.43 45.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.678 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.484 ' CB ' HD22 ' A' ' 43' ' ' LEU . 1.0 OUTLIER -155.2 110.65 3.07 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.783 179.827 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 66.56 38.2 4.22 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.613 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 65.31 44.85 92.91 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.446 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 19.4 m120 -135.78 175.09 9.91 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 120.811 0.338 . . . . 0.0 110.933 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.413 ' C ' ' CD1' ' A' ' 43' ' ' LEU . . . -117.1 104.15 10.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.905 179.834 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.583 ' N ' ' CD1' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -114.73 118.92 34.98 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.25 -179.786 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.471 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.7 t -71.13 128.48 34.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.369 179.368 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.584 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 1.9 m -106.17 157.82 17.28 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.148 -179.598 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.443 ' O ' ' CE1' ' A' ' 48' ' ' TYR . 8.6 m -146.63 121.51 9.97 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.083 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.455 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 18.3 t -79.95 134.29 36.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.97 -179.826 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.454 ' HB2' ' HB3' ' A' ' 52' ' ' ARG . 1.4 m-85 -104.95 -45.94 4.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.983 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 114.13 -173.86 15.19 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.423 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 39.81 -129.92 2.54 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.535 179.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 18.0 m -102.27 26.13 8.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.767 0.318 . . . . 0.0 110.964 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.454 ' HB3' ' HB2' ' A' ' 48' ' ' TYR . 9.0 mmt180 -87.57 -47.24 8.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.173 -179.846 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 65.3 160.77 0.62 Allowed Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.507 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.573 ' CE1' ' SG ' ' A' ' 45' ' ' CYS . 0.6 OUTLIER -73.99 149.95 41.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.822 0.344 . . . . 0.0 110.835 -179.993 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -112.38 -45.86 3.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.966 -179.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.471 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.1 OUTLIER 72.39 146.16 0.08 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.889 -179.966 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.408 ' CG ' ' N ' ' A' ' 58' ' ' SER . 0.9 OUTLIER -124.48 -89.94 0.57 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.933 179.958 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.481 ' HA ' ' HA ' ' A' ' 43' ' ' LEU . 67.4 m -165.45 177.34 7.54 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.713 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.43 ' HD2' ' O ' ' A' ' 60' ' ' PRO . 0.7 OUTLIER -75.53 109.14 7.05 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.793 179.983 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.458 ' HD3' ' O ' ' A' ' 58' ' ' SER . 57.6 Cg_endo -71.12 -178.16 2.71 Favored 'Trans proline' 0 C--O 1.231 0.149 0 C-N-CA 122.751 2.301 . . . . 0.0 112.445 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -143.77 57.48 1.35 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.739 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . 56.0 -169.98 0.08 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.071 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.407 ' HG3' ' N ' ' A' ' 64' ' ' GLU . 1.1 tt0 -109.75 150.12 28.8 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.592 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.407 ' N ' ' HG3' ' A' ' 63' ' ' GLU . 16.8 tt0 -127.13 51.18 1.91 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.964 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -165.91 143.64 5.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.114 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 5.1 m -124.59 -172.17 2.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.766 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.562 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 87.8 t80 -161.78 118.59 2.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.067 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . 0.428 ' O ' ' C ' ' A' ' 69' ' ' LYS . 3.7 t0 -92.22 76.79 5.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.728 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.562 ' HA ' ' CE2' ' A' ' 67' ' ' PHE . 1.3 ptmt -35.18 -35.85 0.05 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.984 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . 0.418 ' N ' ' O ' ' A' ' 68' ' ' ASP . 18.6 m-30 -40.29 -57.24 1.79 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.911 179.875 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 20.5 p -140.48 32.33 1.87 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.105 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 46.36 95.45 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.54 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . 0.464 ' O ' ' HA ' ' A' ' 67' ' ' PHE . 2.0 m-80 -147.18 162.88 37.98 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.792 0.33 . . . . 0.0 110.983 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -132.87 104.59 6.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.154 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.592 ' CD2' ' CE1' ' A' ' 81' ' ' TYR . 0.7 OUTLIER -108.45 13.54 25.38 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.882 -179.926 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . 0.427 ' O ' ' O ' ' A' ' 75' ' ' TYR . 70.9 mtt85 49.15 178.71 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.767 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.444 ' CG2' ' O ' ' A' ' 77' ' ' VAL . 12.2 p -95.53 28.17 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.153 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -146.44 14.15 1.61 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.424 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -134.01 127.53 32.49 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.811 0.338 . . . . 0.0 111.02 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 22.2 p -92.51 164.16 13.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.118 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.592 ' CE1' ' CD2' ' A' ' 75' ' ' TYR . 47.9 p90 -158.55 166.1 32.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.92 -179.927 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -117.18 116.32 27.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.804 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 20.8 mmt-85 -118.23 117.05 35.24 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.946 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -71.96 106.94 2.11 Favored 'Trans proline' 0 C--N 1.342 0.222 0 C-N-CA 122.7 2.267 . . . . 0.0 112.291 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.463 ' O ' ' CB ' ' A' ' 86' ' ' ASP . 1.5 mmpp? -117.61 107.87 14.76 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.876 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.463 ' CB ' ' O ' ' A' ' 85' ' ' LYS . 0.4 OUTLIER 81.85 -153.7 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.801 -179.965 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -81.11 6.95 12.2 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.067 179.904 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 1.4 tpt -137.92 149.22 46.01 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.861 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.53 ' C ' ' CD1' ' A' ' 90' ' ' TRP . 1.4 mt -110.36 154.2 11.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.198 -179.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . 0.631 ' N ' ' CD1' ' A' ' 90' ' ' TRP . 0.1 OUTLIER -143.23 150.04 38.77 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.776 179.912 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.447 ' OD1' ' HB3' ' A' ' 108' ' ' ASN . 0.2 OUTLIER -83.28 65.38 8.25 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.957 179.979 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . 0.4 ' HA ' ' HA ' ' A' ' 104' ' ' CYS . 21.4 m -48.12 137.14 10.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.111 179.928 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 18.3 m -145.08 137.52 26.04 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.068 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 5.1 t -74.42 71.82 1.81 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.942 -179.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.488 HD11 HG21 ' A' ' 95' ' ' ILE . 2.3 mt -81.25 66.66 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.296 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.447 ' O ' ' CB ' ' A' ' 97' ' ' ALA . . . 153.1 -83.24 0.16 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.375 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.447 ' CB ' ' O ' ' A' ' 96' ' ' GLY . . . 80.18 80.71 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.803 0.335 . . . . 0.0 111.137 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.54 0.02 86.58 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.589 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 17.9 mtp85 -139.73 -55.53 0.56 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.814 0.34 . . . . 0.0 110.981 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . 0.412 ' CA ' ' CZ ' ' A' ' 101' ' ' ARG . . . -85.61 -103.96 0.7 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.473 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.412 ' CZ ' ' CA ' ' A' ' 100' ' ' GLY . 0.0 OUTLIER 179.73 169.51 1.15 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.766 0.317 . . . . 0.0 110.895 -179.925 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 3.7 mt -97.1 64.77 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.079 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 19.2 t -45.42 155.95 0.13 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.852 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.4 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 81.1 m -150.97 96.36 2.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.945 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' THR . . . . . 0.402 ' O ' ' N ' ' A' ' 91' ' ' ASP . 0.1 OUTLIER -91.37 150.89 21.08 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.129 -179.965 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.534 HD12 ' CZ3' ' A' ' 90' ' ' TRP . 2.3 mp -65.79 144.5 14.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.048 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . 43.64 -163.9 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.086 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . 0.464 ' OD1' ' N ' ' A' ' 108' ' ' ASN . 4.7 p-10 -146.95 157.25 43.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.83 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . 0.435 ' HG2' ' O ' ' A' ' 108' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.959 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 23.3 t . . . . . 0 N--CA 1.486 1.331 0 CA-C-O 120.843 0.354 . . . . 0.0 111.218 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -143.83 109.74 5.16 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.899 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -78.06 159.86 30.26 Favored 'Trans proline' 0 N--CA 1.464 -0.263 0 C-N-CA 122.812 2.341 . . . . 0.0 112.312 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.404 ' HA3' ' CE1' ' A' ' 27' ' ' HIS . . . 138.36 -151.72 21.63 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.665 -0.779 . . . . 0.0 112.615 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -158.07 64.83 0.45 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.852 0.358 . . . . 0.0 110.831 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -45.46 137.89 4.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.841 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -162.99 119.82 1.88 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.891 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.404 ' O ' ' CG ' ' A' ' 24' ' ' ASN . 36.6 t30 54.79 30.4 13.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.919 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 85.64 -10.33 65.11 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.539 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.84 128.19 39.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.813 0.34 . . . . 0.0 110.862 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . 0.404 ' CE1' ' HA3' ' A' ' 20' ' ' GLY . 28.6 t-80 -115.28 94.26 4.65 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.193 -179.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -81.71 -168.97 2.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.803 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.531 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 43.1 tt0 -106.01 141.41 37.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.851 179.862 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.524 ' CG2' ' O ' ' A' ' 48' ' ' TYR . 3.6 mp -48.97 146.14 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.252 -179.859 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.453 ' OD1' HG21 ' A' ' 30' ' ' ILE . 0.6 OUTLIER 67.5 12.64 9.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.901 -179.998 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.531 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 52.6 tt0 -98.65 151.63 20.49 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.637 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 18.9 mt-30 -114.57 152.35 31.92 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.096 -179.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . 0.541 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 43.4 p90 -153.05 179.08 9.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.78 179.783 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -109.74 127.73 54.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.866 0.365 . . . . 0.0 111.305 -179.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.521 ' O ' ' N ' ' A' ' 43' ' ' LEU . 39.5 ttt-85 -133.4 171.67 13.74 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.341 179.631 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.431 ' O ' HG21 ' A' ' 37' ' ' THR . 1.5 t -135.29 139.88 44.71 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.782 0.325 . . . . 0.0 111.352 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.442 ' HB2' HD23 ' A' ' 43' ' ' LEU . 3.6 t80 -126.79 126.61 43.7 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.638 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.9 mm? 63.11 25.78 15.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.574 -179.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 76.22 43.07 21.97 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 121.041 -0.599 . . . . 0.0 112.667 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.429 ' O ' ' C ' ' A' ' 42' ' ' ALA . 32.6 m120 -145.56 129.86 17.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.796 0.331 . . . . 0.0 111.074 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.429 ' C ' ' O ' ' A' ' 41' ' ' ASN . . . -37.5 153.98 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.458 179.687 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.521 ' N ' ' O ' ' A' ' 36' ' ' ARG . 4.4 tp -169.52 161.34 9.59 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.082 0.468 . . . . 0.0 111.618 -179.527 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.482 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 19.6 t -124.36 155.88 32.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.232 179.267 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.57 ' SG ' ' CD1' ' A' ' 54' ' ' PHE . 0.5 OUTLIER -139.46 150.46 45.22 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.939 0.4 . . . . 0.0 111.423 -179.618 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 97.9 m -133.89 115.98 15.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.811 179.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.483 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 36.9 t -71.73 156.35 39.44 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.971 -179.844 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.524 ' O ' ' CG2' ' A' ' 30' ' ' ILE . 42.3 m-85 -119.25 -53.28 2.25 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.151 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.472 ' HA2' ' CG2' ' A' ' 30' ' ' ILE . . . 156.82 52.49 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.456 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 48.63 50.21 25.69 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.526 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -149.4 -61.6 0.22 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.832 0.349 . . . . 0.0 110.842 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.517 ' HA ' ' NE ' ' A' ' 52' ' ' ARG . 8.5 mmm180 -68.46 -31.6 71.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.781 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . 0.577 ' O ' ' CD2' ' A' ' 54' ' ' PHE . . . 88.02 24.3 35.33 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 120.881 -0.676 . . . . 0.0 112.533 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.577 ' CD2' ' O ' ' A' ' 53' ' ' GLY . 1.5 p90 56.04 151.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.943 0.402 . . . . 0.0 111.106 179.839 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.401 ' O ' ' OD1' ' A' ' 55' ' ' ASN . 43.6 p-10 -130.44 109.38 10.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.64 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.482 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.7 OUTLIER -83.73 170.06 14.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.103 -179.855 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 172.31 166.76 0.11 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.963 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.451 ' HA ' HD13 ' A' ' 43' ' ' LEU . 5.0 t -58.6 154.68 13.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.951 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.462 ' HG3' ' HD2' ' A' ' 60' ' ' PRO . 0.0 OUTLIER -79.97 131.89 62.04 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.835 -179.975 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.462 ' HD2' ' HG3' ' A' ' 59' ' ' LYS . 36.2 Cg_endo -65.31 -12.75 36.34 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.686 2.257 . . . . 0.0 112.264 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 10.5 tt0 38.86 46.29 1.05 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.936 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -119.14 166.69 12.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.177 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.404 ' OE2' ' HB2' ' A' ' 97' ' ' ALA . 0.8 OUTLIER -115.8 -21.42 9.61 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.503 -179.931 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.43 ' O ' HG23 ' A' ' 65' ' ' THR . 0.1 OUTLIER 179.5 -166.38 0.07 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.894 -179.968 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.43 HG23 ' O ' ' A' ' 64' ' ' GLU . 30.5 p -158.02 146.03 18.66 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.215 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 25.9 p -121.43 -175.81 3.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.788 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.512 ' CE1' ' HA2' ' A' ' 72' ' ' GLY . 76.6 t80 -137.78 127.79 25.77 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.922 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 33.3 t0 -92.1 92.64 8.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.909 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.473 ' HA ' ' CE2' ' A' ' 67' ' ' PHE . 0.8 OUTLIER -47.79 -25.44 1.27 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.005 -179.967 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . 0.418 ' C ' ' O ' ' A' ' 69' ' ' LYS . 8.2 m-30 -36.27 -59.37 0.63 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.829 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -159.77 30.51 0.19 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.15 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . 0.512 ' HA2' ' CE1' ' A' ' 67' ' ' PHE . . . 71.88 74.48 0.74 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.674 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -138.45 90.83 2.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.723 0.297 . . . . 0.0 110.714 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.469 HG21 ' N ' ' A' ' 75' ' ' TYR . 34.0 m -69.11 137.32 53.34 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.146 -179.97 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.469 ' N ' HG21 ' A' ' 74' ' ' THR . 66.3 m-85 -126.95 155.55 42.93 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.794 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 11.5 mtp180 -84.22 127.82 34.19 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.917 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 43.0 t -44.72 -27.03 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.108 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -90.08 26.71 9.38 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.589 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -158.39 134.88 9.47 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.826 0.346 . . . . 0.0 111.0 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 5.3 t -111.17 165.28 12.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.905 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.441 ' CE1' ' CD2' ' A' ' 75' ' ' TYR . 19.1 p90 -143.73 173.86 11.31 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.892 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -148.46 110.76 4.65 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.773 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.3 143.56 47.63 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.963 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -68.09 139.0 45.31 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.84 2.36 . . . . 0.0 112.29 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.431 ' O ' ' O ' ' A' ' 88' ' ' MET . 0.1 OUTLIER -160.47 133.58 6.63 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.899 179.943 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.404 ' O ' ' OG ' ' A' ' 87' ' ' SER . 0.9 OUTLIER 56.48 52.16 10.31 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.906 179.989 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' SER . . . . . 0.404 ' OG ' ' O ' ' A' ' 86' ' ' ASP . 1.8 p 53.38 23.16 3.17 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.878 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' MET . . . . . 0.431 ' O ' ' O ' ' A' ' 85' ' ' LYS . 0.2 OUTLIER -150.49 143.67 24.88 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.915 179.925 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 4.4 mt -108.5 136.53 43.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.166 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . 0.631 ' N ' ' CD1' ' A' ' 90' ' ' TRP . 0.1 OUTLIER -131.18 140.86 49.98 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.74 179.955 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -79.57 52.67 1.44 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.699 179.887 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . 0.456 ' HA ' ' HA ' ' A' ' 104' ' ' CYS . 70.9 m -41.43 111.29 0.21 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.087 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.426 ' O ' ' N ' ' A' ' 95' ' ' ILE . 51.9 m -98.34 132.87 43.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.894 179.83 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 43.5 t -65.89 61.98 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.935 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.426 ' N ' ' O ' ' A' ' 93' ' ' THR . 2.5 mt -69.62 105.23 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.205 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -142.56 -119.23 1.43 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.635 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.41 ' HA ' ' HG3' ' A' ' 64' ' ' GLU . . . 67.47 -74.35 0.07 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.831 0.348 . . . . 0.0 110.981 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -128.64 80.41 0.36 Allowed Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.827 -0.702 . . . . 0.0 112.318 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 2.2 mtt-85 62.75 13.35 6.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.811 0.339 . . . . 0.0 110.675 -179.795 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . 0.453 ' O ' ' HB3' ' A' ' 101' ' ' ARG . . . -43.72 -52.09 6.66 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.601 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.453 ' HB3' ' O ' ' A' ' 100' ' ' GLY . 0.0 OUTLIER 68.39 112.44 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.806 0.336 . . . . 0.0 110.73 -179.945 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . 0.43 ' C ' ' O ' ' A' ' 101' ' ' ARG . 2.3 mp -34.95 151.53 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.224 -179.883 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 4.7 t -146.04 128.91 16.36 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.831 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.456 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 70.9 m -111.66 138.29 48.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.096 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -144.46 140.73 29.12 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.891 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.511 HD13 ' CZ3' ' A' ' 90' ' ' TRP . 2.8 mp -82.0 114.16 22.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.106 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -113.48 143.82 43.87 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.165 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 7.0 p-10 -123.61 115.57 21.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.949 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.248 0.992 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.88 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.401 ' O ' ' C ' ' A' ' 18' ' ' LYS . 4.7 t . . . . . 0 N--CA 1.487 1.405 0 CA-C-O 120.797 0.332 . . . . 0.0 111.165 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.401 ' C ' ' O ' ' A' ' 17' ' ' SER . 0.9 OUTLIER 38.35 71.19 1.12 Allowed Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.868 179.922 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -52.35 142.88 45.78 Favored 'Trans proline' 0 N--CA 1.465 -0.193 0 C-N-CA 122.758 2.305 . . . . 0.0 112.206 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.417 ' C ' ' SG ' ' A' ' 21' ' ' CYS . . . 160.99 -153.26 24.06 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.482 -179.833 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.417 ' SG ' ' C ' ' A' ' 20' ' ' GLY . 0.0 OUTLIER -159.82 93.0 1.06 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.844 0.354 . . . . 0.0 110.828 179.985 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.456 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 6.5 t80 -96.26 101.34 12.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.96 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.494 ' OD2' ' CE2' ' A' ' 54' ' ' PHE . 9.5 t70 -128.4 133.72 48.66 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.858 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 45.6 t30 51.66 28.44 4.77 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.015 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 86.61 -2.22 87.28 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.519 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.577 ' HB3' ' CZ ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -95.7 137.84 34.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.831 0.348 . . . . 0.0 110.95 179.913 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 -114.37 85.76 2.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.906 -179.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.577 ' CZ ' ' HB3' ' A' ' 26' ' ' LYS . 2.3 m-85 -79.64 176.48 9.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.961 -179.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.513 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 1.2 tt0 -104.09 136.91 42.84 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.56 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.475 HG23 ' ND2' ' A' ' 31' ' ' ASN . 3.8 mp -40.76 146.85 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.33 -179.877 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.475 ' ND2' HG23 ' A' ' 30' ' ' ILE . 69.7 m-80 67.9 10.68 7.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.303 179.71 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.513 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 59.9 tt0 -94.62 149.29 21.39 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.806 0.336 . . . . 0.0 110.828 179.79 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -113.38 147.19 38.2 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.209 -179.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . 0.501 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 42.6 p90 -157.27 -164.45 1.59 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.494 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -128.89 122.73 30.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.86 0.362 . . . . 0.0 111.191 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.454 ' O ' HD22 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -114.92 131.19 56.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.546 179.751 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.4 m -99.83 129.41 45.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.681 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.467 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 1.5 t80 -145.14 112.59 6.18 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.854 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.467 ' HB2' ' O ' ' A' ' 38' ' ' TYR . 0.3 OUTLIER 77.74 56.97 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.658 -179.924 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 48.91 28.94 7.77 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.357 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 34.7 m-80 -140.45 138.85 35.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.795 0.331 . . . . 0.0 110.995 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.496 ' C ' ' CD1' ' A' ' 43' ' ' LEU . . . -87.81 126.43 35.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.169 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.496 ' CD1' ' C ' ' A' ' 42' ' ' ALA . 0.0 OUTLIER -124.34 123.03 39.31 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.306 -0.407 . . . . 0.0 111.175 -179.965 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.467 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.7 t -67.15 133.24 31.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.337 -0.392 . . . . 0.0 109.972 179.17 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.571 ' SG ' ' CD1' ' A' ' 54' ' ' PHE . 1.6 m -115.0 167.35 10.88 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.05 0.452 . . . . 0.0 111.76 -179.037 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.497 ' O ' ' CE1' ' A' ' 48' ' ' TYR . 7.2 m -157.96 118.34 3.39 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.773 -0.648 . . . . 0.0 110.697 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.472 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 12.4 t -78.27 136.05 37.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.207 -179.584 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.497 ' CE1' ' O ' ' A' ' 46' ' ' THR . 5.4 m-85 -111.07 -32.29 6.84 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.908 179.848 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.431 ' HA3' HG21 ' A' ' 30' ' ' ILE . . . 76.6 -170.82 54.98 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.486 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . 0.526 ' O ' ' CB ' ' A' ' 51' ' ' SER . . . 54.4 25.46 34.08 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.522 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.526 ' CB ' ' O ' ' A' ' 50' ' ' GLY . 3.2 m 85.06 -13.29 0.67 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.835 0.35 . . . . 0.0 111.157 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.455 ' HB2' ' HB2' ' A' ' 48' ' ' TYR . 60.7 mtt180 -57.58 -28.85 63.97 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.929 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 58.74 168.65 0.2 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.454 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.571 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 7.6 p90 -84.11 146.66 27.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.765 0.316 . . . . 0.0 110.815 -179.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -101.95 -47.82 4.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.018 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.473 ' HA ' ' HA ' ' A' ' 45' ' ' CYS . 0.1 OUTLIER 71.31 159.42 0.21 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.813 -179.881 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.4 ' CG ' ' N ' ' A' ' 58' ' ' SER . 1.5 tp10 -141.65 -93.5 0.14 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.15 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.488 ' HA ' ' HA ' ' A' ' 43' ' ' LEU . 21.7 m -171.63 160.96 5.98 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.88 0.371 . . . . 0.0 111.02 -179.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.452 ' HG2' ' HD2' ' A' ' 60' ' ' PRO . 11.7 tmtt? -126.61 133.32 24.88 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.804 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.452 ' HD2' ' HG2' ' A' ' 59' ' ' LYS . 83.2 Cg_exo -44.92 110.98 0.26 Allowed 'Trans proline' 0 N--CA 1.464 -0.261 0 C-N-CA 122.811 2.341 . . . . 0.0 112.399 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -49.69 -22.31 1.32 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.961 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.56 105.29 4.15 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.117 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.434 ' HG3' ' N ' ' A' ' 64' ' ' GLU . 1.9 tt0 -113.38 163.49 14.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.544 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.434 ' N ' ' HG3' ' A' ' 63' ' ' GLU . 13.6 tt0 -169.46 46.07 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.933 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -142.15 166.5 24.54 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.211 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.511 ' HA ' ' CA ' ' A' ' 98' ' ' GLY . 3.8 m -149.95 -176.03 5.28 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.917 -179.846 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.559 ' CE2' ' HA2' ' A' ' 72' ' ' GLY . 27.8 t80 -178.61 93.62 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.887 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . 0.468 ' O ' ' O ' ' A' ' 69' ' ' LYS . 13.6 t70 -93.98 38.18 1.08 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.928 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.468 ' HA ' ' CE1' ' A' ' 67' ' ' PHE . 1.3 pttt 36.6 -159.73 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.953 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . 0.466 ' HB2' ' O ' ' A' ' 69' ' ' LYS . 21.9 m-85 73.32 -54.71 0.69 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.964 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 13.2 p -135.14 12.97 3.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.027 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . 0.559 ' HA2' ' CE2' ' A' ' 67' ' ' PHE . . . 46.43 24.63 1.72 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.564 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . 0.452 ' HB3' ' CE1' ' A' ' 75' ' ' TYR . 1.1 t-20 -72.21 109.6 6.07 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.758 0.314 . . . . 0.0 110.929 -179.933 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 92.3 m -78.48 112.11 15.2 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.015 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.659 ' CE2' ' CE2' ' A' ' 81' ' ' TYR . 9.1 m-85 -94.37 -175.77 3.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.898 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . 0.43 ' HD2' ' HA ' ' A' ' 76' ' ' ARG . 0.2 OUTLIER -104.61 126.46 51.72 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.819 179.991 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.433 ' HA ' ' HB3' ' A' ' 94' ' ' CYS . 31.9 t -62.62 -14.94 14.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.213 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -102.39 16.2 55.4 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.475 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -155.69 163.74 39.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.812 0.339 . . . . 0.0 110.922 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 30.6 p -95.99 167.39 11.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.217 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.659 ' CE2' ' CE2' ' A' ' 75' ' ' TYR . 15.6 p90 -146.2 131.68 18.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.858 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.52 ' OE2' ' CG2' ' A' ' 89' ' ' ILE . 0.8 OUTLIER -70.96 113.32 7.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.02 -179.951 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.508 ' HA ' ' NE ' ' A' ' 83' ' ' ARG . 0.7 OUTLIER -120.71 81.22 32.88 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.768 179.822 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_exo -44.58 116.6 1.15 Allowed 'Trans proline' 0 N--CA 1.465 -0.173 0 C-N-CA 122.877 2.385 . . . . 0.0 112.433 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -132.66 122.11 24.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.897 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 3.7 t0 72.84 -156.53 0.08 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.84 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.17 8.04 12.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.952 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -128.64 160.32 32.8 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.915 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.521 ' O ' ' CG2' ' A' ' 106' ' ' ILE . 2.6 mp -107.81 128.18 63.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.027 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . 0.5 ' CZ3' ' CD1' ' A' ' 106' ' ' ILE . 1.0 OUTLIER -122.21 136.5 54.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.981 -179.987 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -93.15 57.81 2.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.803 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . 0.46 ' HA ' ' HA ' ' A' ' 104' ' ' CYS . 0.7 OUTLIER -38.21 151.63 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.095 -179.94 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 88.7 m -128.2 128.71 45.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.977 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . 0.433 ' HB3' ' HA ' ' A' ' 77' ' ' VAL . 16.2 t -64.66 88.3 0.06 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.01 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.408 ' HB ' ' O ' ' A' ' 101' ' ' ARG . 0.8 OUTLIER -101.8 46.62 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.168 179.998 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 172.64 -159.6 30.37 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.476 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -90.98 63.65 5.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.836 0.351 . . . . 0.0 111.044 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . 0.511 ' CA ' ' HA ' ' A' ' 66' ' ' CYS . . . 68.12 10.36 59.15 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.489 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 171.59 51.32 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.838 0.351 . . . . 0.0 110.945 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -111.88 -62.13 0.46 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.371 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.408 ' O ' ' HB ' ' A' ' 95' ' ' ILE . 0.4 OUTLIER -141.45 38.89 1.71 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.95 0.405 . . . . 0.0 110.827 179.808 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . 0.463 HG22 ' OH ' ' A' ' 81' ' ' TYR . 2.7 mt -56.96 89.25 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.168 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 27.0 t -84.71 138.72 32.48 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.791 179.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.46 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 0.5 OUTLIER -110.93 141.63 44.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.982 -179.931 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 1.5 t -156.89 121.55 4.48 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.054 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.521 ' CG2' ' O ' ' A' ' 89' ' ' ILE . 1.7 mp -66.48 138.84 22.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.086 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -64.65 106.2 1.13 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.167 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -105.61 111.68 24.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.876 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.252 -0.88 . . . . 0.0 110.971 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 22.7 t . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 120.836 0.351 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 3.1 mmtp -110.61 136.4 20.65 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.94 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -75.99 156.25 38.62 Favored 'Trans proline' 0 C--O 1.232 0.223 0 C-N-CA 122.832 2.355 . . . . 0.0 112.391 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 73.11 -154.44 49.53 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.873 -0.679 . . . . 0.0 112.455 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 85.0 m -138.99 135.16 34.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.837 0.351 . . . . 0.0 110.922 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 47.7 t80 -110.3 119.84 40.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.877 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -167.73 151.61 6.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.916 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.491 ' O ' ' ND2' ' A' ' 24' ' ' ASN . 17.6 t30 55.35 51.03 13.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.908 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 47.56 23.26 2.07 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.482 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.539 ' HB3' ' CE2' ' A' ' 28' ' ' TYR . 0.1 OUTLIER -132.29 139.12 48.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.842 0.353 . . . . 0.0 110.865 -179.977 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -109.23 85.9 2.19 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.947 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.539 ' CE2' ' HB3' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -79.84 165.15 23.0 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.815 179.948 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.523 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 0.0 OUTLIER -100.25 162.33 13.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.741 179.806 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.411 ' HA ' ' SG ' ' A' ' 47' ' ' CYS . 3.5 mp -49.53 156.23 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.351 -179.868 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 56.86 19.65 4.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.066 179.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.523 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 10.1 tt0 -101.29 147.69 26.0 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.825 0.345 . . . . 0.0 110.91 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 14.2 mt-30 -116.75 145.46 43.47 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.016 -179.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . 0.581 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 42.0 p90 -150.35 168.88 22.79 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.785 179.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 76.2 tt0 -101.15 126.53 47.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.171 -179.741 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.454 ' HB2' ' SG ' ' A' ' 56' ' ' CYS . 1.5 mtp180 -119.4 176.95 5.1 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.674 179.847 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -144.61 132.46 21.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.701 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.461 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 0.6 OUTLIER -154.76 143.59 20.84 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.678 179.671 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.461 ' HB2' ' O ' ' A' ' 38' ' ' TYR . 3.4 mm? 66.76 22.51 10.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.484 -179.678 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 69.69 38.85 77.74 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.531 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -152.08 153.3 33.66 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-O 120.708 0.29 . . . . 0.0 110.984 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.5 ' O ' ' CD1' ' A' ' 43' ' ' LEU . . . -60.75 146.58 45.44 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.946 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.5 ' CD1' ' O ' ' A' ' 42' ' ' ALA . 4.3 mp -142.18 161.5 37.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.929 0.395 . . . . 0.0 111.364 -179.674 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.487 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.2 t -128.9 123.65 59.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.244 179.353 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.581 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 1.3 m -109.8 158.76 17.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.618 -179.263 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 24.7 m -146.38 119.53 8.86 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.797 179.644 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.521 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 28.7 t -74.16 143.69 45.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.158 -179.795 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.461 ' N ' ' O ' ' A' ' 53' ' ' GLY . 26.2 m-85 -119.4 -24.66 6.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.948 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 123.87 -169.07 15.98 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.453 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . 0.516 ' O ' ' CB ' ' A' ' 51' ' ' SER . . . -75.17 85.94 0.8 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.601 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.516 ' CB ' ' O ' ' A' ' 50' ' ' GLY . 0.3 OUTLIER 160.0 -62.91 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.823 0.344 . . . . 0.0 110.849 179.976 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -85.07 -29.94 24.49 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.024 -179.897 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . 0.461 ' O ' ' N ' ' A' ' 48' ' ' TYR . . . 70.34 -111.51 3.82 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.522 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.566 ' CE1' ' SG ' ' A' ' 45' ' ' CYS . 1.8 p90 -153.65 154.21 33.74 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.893 0.378 . . . . 0.0 110.886 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -133.2 93.96 3.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.622 179.777 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.487 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.4 OUTLIER -68.0 166.79 15.13 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.146 -179.673 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.482 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 14.6 tt0 -152.75 -89.69 0.05 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.131 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.482 ' N ' ' HG2' ' A' ' 57' ' ' GLU . 0.1 OUTLIER -164.49 -167.18 1.22 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.976 179.953 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.45 ' O ' ' O ' ' A' ' 60' ' ' PRO . 0.0 OUTLIER -164.47 110.78 0.88 Allowed Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.972 -179.948 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.45 ' O ' ' O ' ' A' ' 59' ' ' LYS . 63.8 Cg_exo -51.46 -163.1 0.0 OUTLIER 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.703 2.269 . . . . 0.0 112.342 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -121.3 -66.16 1.07 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.894 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -125.33 163.76 21.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.113 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.432 ' O ' ' HB2' ' A' ' 97' ' ' ALA . 2.8 tt0 -95.19 -18.63 20.74 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.452 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -66.57 -169.02 0.07 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.826 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 7.2 p 48.01 -177.56 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.18 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.412 ' SG ' ' HB2' ' A' ' 75' ' ' TYR . 18.5 p -150.12 -156.33 0.71 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.791 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.465 ' O ' ' N ' ' A' ' 69' ' ' LYS . 12.6 t80 -168.32 81.77 0.17 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.891 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -52.74 87.08 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.872 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.465 ' N ' ' O ' ' A' ' 67' ' ' PHE . 2.0 pttt -52.67 -29.84 28.68 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.862 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . 0.403 ' C ' ' O ' ' A' ' 69' ' ' LYS . 8.3 m-30 -38.4 -56.49 1.24 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.903 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -122.58 -8.08 8.55 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.09 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 80.12 69.67 1.38 Allowed Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.511 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 12.8 m120 -122.37 -162.88 1.03 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.942 0.401 . . . . 0.0 110.965 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 18.0 m -144.39 105.21 4.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.976 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.412 ' HB2' ' SG ' ' A' ' 66' ' ' CYS . 19.3 m-85 -120.68 160.38 23.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.747 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -91.58 146.56 23.69 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.797 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 93.7 t -45.59 -37.74 2.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.096 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -95.39 14.8 64.46 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.515 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -107.52 100.69 10.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.922 0.391 . . . . 0.0 110.996 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 64.6 p -73.98 143.6 45.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.205 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.421 ' CD2' ' O ' ' A' ' 81' ' ' TYR . 42.2 p90 -133.88 109.98 9.42 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.784 179.842 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -50.4 168.24 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.083 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -167.66 86.58 0.75 Allowed Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.801 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.425 ' HA ' HG12 ' A' ' 89' ' ' ILE . 49.4 Cg_endo -69.13 91.94 0.45 Allowed 'Trans proline' 0 C--O 1.232 0.195 0 C-N-CA 122.734 2.289 . . . . 0.0 112.402 -179.89 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 2.8 mttt -128.26 132.54 48.72 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.788 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 4.8 t0 74.95 10.23 3.85 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.884 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 66.3 30.4 9.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.852 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' MET . . . . . 0.456 ' HG2' HD13 ' A' ' 106' ' ' ILE . 2.3 tpt -120.45 -29.91 4.67 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.919 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.448 ' C ' ' CD1' ' A' ' 90' ' ' TRP . 84.4 mt 58.77 129.02 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.057 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . 0.589 ' N ' ' CD1' ' A' ' 90' ' ' TRP . 0.7 OUTLIER -136.15 132.49 36.07 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.852 -179.992 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.468 ' N ' ' O ' ' A' ' 105' ' ' THR . 0.5 OUTLIER -70.77 62.22 0.27 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.865 -179.972 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 64.2 m -51.48 136.74 25.39 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.998 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.517 ' O ' ' N ' ' A' ' 95' ' ' ILE . 0.2 OUTLIER -126.84 124.83 40.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.912 179.872 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -60.37 73.14 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.938 -179.897 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.517 ' N ' ' O ' ' A' ' 93' ' ' THR . 1.9 mt -88.89 58.81 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.238 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 174.24 161.85 24.91 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.481 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.432 ' HB2' ' O ' ' A' ' 63' ' ' GLU . . . -107.71 53.32 0.69 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.817 0.341 . . . . 0.0 110.961 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 95.75 -3.39 65.21 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.523 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.456 ' HG2' ' O ' ' A' ' 99' ' ' ARG . 1.9 ttm180 -173.23 40.83 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.859 0.361 . . . . 0.0 110.94 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . 0.453 ' O ' ' HB3' ' A' ' 101' ' ' ARG . . . -94.82 -79.85 1.47 Allowed Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.43 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.453 ' HB3' ' O ' ' A' ' 100' ' ' GLY . 0.0 OUTLIER 171.33 51.33 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.758 0.313 . . . . 0.0 110.9 179.992 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . 0.463 ' N ' HD12 ' A' ' 102' ' ' ILE . 3.5 mm -37.11 97.88 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.143 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.402 ' N ' ' O ' ' A' ' 101' ' ' ARG . 3.4 t -71.92 157.49 37.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.948 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 89.5 m -150.03 114.37 5.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.924 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' THR . . . . . 0.468 ' O ' ' N ' ' A' ' 91' ' ' ASP . 8.8 t -129.63 154.27 47.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.19 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.577 HD13 ' CH2' ' A' ' 90' ' ' TRP . 2.9 mt -87.72 125.23 41.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.019 179.828 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -173.53 117.69 0.27 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.124 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -128.89 165.84 20.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.926 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 12.1 ttp180 . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.204 -0.903 . . . . 0.0 110.927 179.928 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 120.857 0.36 . . . . 0.0 111.188 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 3.4 mtmp? -153.16 127.71 4.65 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.919 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -76.3 138.53 20.09 Favored 'Trans proline' 0 N--CA 1.463 -0.318 0 C-N-CA 122.799 2.333 . . . . 0.0 112.4 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 114.37 162.91 14.41 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.499 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 86.9 m -116.54 115.26 25.43 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.808 0.337 . . . . 0.0 110.863 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -91.26 114.35 26.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.951 -179.955 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -154.59 156.05 35.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.963 -179.906 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 46.1 t30 52.36 27.11 4.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.955 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 76.07 1.02 67.05 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.545 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 2.5 mptt -110.96 148.59 32.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.831 0.348 . . . . 0.0 110.939 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 4.5 t-160 -117.15 88.81 2.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.863 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -79.64 -175.19 4.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.96 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.506 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 10.6 tt0 -105.92 156.55 18.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.895 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.441 ' HA ' ' SG ' ' A' ' 47' ' ' CYS . 3.3 mp -52.8 156.59 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.34 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER 59.42 14.22 3.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.981 179.866 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.506 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 21.1 tt0 -96.06 155.09 16.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.933 179.938 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 40.4 mt-30 -122.87 134.65 54.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.981 -179.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . 0.576 ' CZ2' ' HB3' ' A' ' 45' ' ' CYS . 23.4 p90 -136.01 175.07 9.93 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.964 179.827 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -100.37 127.6 46.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.036 -179.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.522 ' O ' ' CB ' ' A' ' 43' ' ' LEU . 17.5 tpt85 -128.31 162.75 26.33 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.643 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -140.54 129.96 23.93 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.562 -179.813 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.461 ' CD1' ' HB2' ' A' ' 39' ' ' LEU . 12.3 t80 -127.73 119.25 25.38 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.914 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.461 ' HB2' ' CD1' ' A' ' 38' ' ' TYR . 3.4 tp 76.26 13.29 2.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.722 -179.824 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 84.66 39.45 8.83 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.7 180.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.42 ' O ' ' C ' ' A' ' 42' ' ' ALA . 7.5 m-80 -141.67 125.52 17.06 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.734 0.302 . . . . 0.0 110.846 179.866 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.464 ' O ' ' CD1' ' A' ' 43' ' ' LEU . . . -35.55 147.77 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.946 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.522 ' CB ' ' O ' ' A' ' 36' ' ' ARG . 1.1 tp -159.28 150.7 20.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.224 -179.608 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.475 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 3.1 t -122.37 135.48 62.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.358 179.541 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.576 ' HB3' ' CZ2' ' A' ' 34' ' ' TRP . 0.7 OUTLIER -118.69 157.13 28.05 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.396 -179.429 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.434 ' O ' ' CE1' ' A' ' 48' ' ' TYR . 76.1 m -140.44 116.17 10.24 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.97 179.799 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.523 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 19.4 t -75.59 132.38 40.61 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.979 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.434 ' CE1' ' O ' ' A' ' 46' ' ' THR . 7.3 m-85 -105.52 -26.04 12.06 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.749 179.883 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.404 ' HA3' HG21 ' A' ' 30' ' ' ILE . . . 87.02 163.24 38.63 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.551 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 58.79 -129.99 50.4 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.529 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -96.48 -13.06 23.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.848 0.356 . . . . 0.0 110.849 -179.918 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -50.41 -33.49 20.95 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.96 -179.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 63.72 161.02 0.35 Allowed Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.785 -0.722 . . . . 0.0 112.537 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.574 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 4.0 p90 -91.45 161.36 15.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.859 0.361 . . . . 0.0 110.851 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -139.9 120.69 14.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.871 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.475 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.8 OUTLIER -90.95 168.2 11.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.938 -179.911 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -176.23 -178.23 0.96 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.978 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.472 ' O ' ' HD3' ' A' ' 60' ' ' PRO . 17.3 m -80.09 160.01 25.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.91 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.429 ' O ' ' OE1' ' A' ' 61' ' ' GLU . 3.1 mttt -81.62 110.62 20.28 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.804 179.915 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.472 ' HD3' ' O ' ' A' ' 58' ' ' SER . 53.7 Cg_exo -51.6 96.72 0.04 OUTLIER 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.66 2.24 . . . . 0.0 112.288 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.429 ' OE1' ' O ' ' A' ' 59' ' ' LYS . 0.5 OUTLIER -112.73 24.65 12.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.988 179.909 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -129.59 127.97 41.75 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.144 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.97 118.35 8.96 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.129 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.412 ' O ' ' O ' ' A' ' 65' ' ' THR . 0.1 OUTLIER -68.05 -166.89 0.07 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.911 179.959 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.412 ' O ' ' O ' ' A' ' 64' ' ' GLU . 6.2 p 46.45 -175.34 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.014 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.477 ' O ' HG23 ' A' ' 74' ' ' THR . 0.5 OUTLIER -160.91 -175.17 4.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.108 -179.877 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -130.08 143.54 50.85 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.836 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . 0.511 ' O ' ' N ' ' A' ' 72' ' ' GLY . 0.5 OUTLIER -117.3 81.75 1.7 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.914 -179.925 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 28.2 pttt -44.64 -33.54 1.85 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.834 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 4.1 m-30 -44.44 -61.3 1.58 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.809 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -134.03 27.31 3.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.978 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . 0.511 ' N ' ' O ' ' A' ' 68' ' ' ASP . . . 46.51 81.86 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.484 179.926 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . 0.549 ' HB3' ' CZ ' ' A' ' 75' ' ' TYR . 2.5 m120 -148.18 111.86 5.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.824 0.345 . . . . 0.0 110.961 -179.922 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.477 HG23 ' O ' ' A' ' 66' ' ' CYS . 18.7 m -80.21 125.97 30.52 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.954 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.549 ' CZ ' ' HB3' ' A' ' 73' ' ' ASN . 78.2 m-85 -121.26 175.78 5.96 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.634 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 22.1 mtm180 -92.1 154.63 18.6 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.887 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 89.9 t -57.35 -63.32 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.127 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -83.4 51.59 4.6 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.474 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 10.7 t0 -147.55 125.11 11.72 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.779 0.323 . . . . 0.0 110.92 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 44.6 p -86.23 150.24 24.52 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.068 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.437 ' CD2' ' O ' ' A' ' 81' ' ' TYR . 47.2 p90 -148.97 114.54 5.61 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.977 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.465 ' CG ' ' OD1' ' A' ' 91' ' ' ASP . 18.6 mt-10 -65.77 141.56 58.27 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.845 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.21 86.37 31.06 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.798 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 77.7 Cg_exo -49.93 96.8 0.03 OUTLIER 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.723 2.282 . . . . 0.0 112.354 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -121.33 136.5 54.96 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.984 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 53.2 -155.37 0.2 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.946 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 7.7 t -89.2 43.96 1.18 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.996 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' MET . . . . . 0.555 ' O ' ' CD1' ' A' ' 90' ' ' TRP . 2.9 ttm -175.67 126.16 0.23 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.952 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 9.1 mt -87.03 128.71 39.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.037 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . 0.555 ' CD1' ' O ' ' A' ' 88' ' ' MET . 1.2 m95 -119.92 120.45 36.42 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.912 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.465 ' OD1' ' CG ' ' A' ' 82' ' ' GLU . 0.2 OUTLIER -60.58 87.85 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.844 179.94 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 25.4 m -67.77 123.36 20.3 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.985 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.417 ' O ' ' HA ' ' A' ' 102' ' ' ILE . 82.5 m -112.23 136.45 51.63 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.914 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . 0.402 ' N ' HG21 ' A' ' 93' ' ' THR . 44.2 t -70.08 62.58 0.21 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.053 -179.727 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.471 ' HB ' ' O ' ' A' ' 101' ' ' ARG . 2.7 mt -71.4 96.48 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.087 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.52 ' O ' ' N ' ' A' ' 98' ' ' GLY . . . 123.85 103.98 1.61 Allowed Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.363 -179.924 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -49.29 85.28 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.795 0.331 . . . . 0.0 111.356 -179.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . 0.52 ' N ' ' O ' ' A' ' 96' ' ' GLY . . . 119.24 10.98 7.7 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.603 -0.808 . . . . 0.0 113.004 179.693 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.489 ' CB ' ' O ' ' A' ' 98' ' ' GLY . 0.1 OUTLIER 83.29 107.91 0.06 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.922 0.392 . . . . 0.0 110.838 -179.982 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . 0.47 ' O ' ' HG3' ' A' ' 101' ' ' ARG . . . -150.11 -38.46 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.393 179.86 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.471 ' O ' ' HB ' ' A' ' 95' ' ' ILE . 0.7 OUTLIER -146.02 38.58 1.09 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.71 0.291 . . . . 0.0 111.041 179.913 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . 0.43 HG22 ' OH ' ' A' ' 81' ' ' TYR . 17.6 mt -47.59 90.69 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.18 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.462 ' N ' ' O ' ' A' ' 101' ' ' ARG . 0.2 OUTLIER -87.24 149.33 24.66 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.916 179.926 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 3.6 m -134.6 109.22 8.51 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.921 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -106.27 143.2 34.74 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.088 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.549 HD12 ' CZ3' ' A' ' 90' ' ' TRP . 2.5 mp -66.48 94.34 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.117 179.938 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -128.32 113.13 15.23 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.152 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . 0.418 ' O ' ' HB3' ' A' ' 109' ' ' ARG . 21.9 t-20 -175.4 68.16 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.958 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . 0.418 ' HB3' ' O ' ' A' ' 108' ' ' ASN . 4.6 ptp180 . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.899 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.417 ' O ' ' HD3' ' A' ' 19' ' ' PRO . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 120.827 0.346 . . . . 0.0 111.189 . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -38.26 97.51 0.14 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.906 179.929 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.417 ' HD3' ' O ' ' A' ' 17' ' ' SER . 50.9 Cg_exo -54.82 143.39 71.21 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.643 2.229 . . . . 0.0 112.274 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 142.21 -171.88 24.43 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.55 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -159.99 110.42 1.88 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.817 0.341 . . . . 0.0 110.92 -179.94 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -90.05 140.49 29.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.916 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.451 ' OD1' ' O ' ' A' ' 26' ' ' LYS . 1.1 p-10 -126.98 -160.95 1.03 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.848 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.432 ' C ' ' O ' ' A' ' 23' ' ' ASP . 0.7 OUTLIER -34.87 -52.25 0.53 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.009 -0.542 . . . . 0.0 111.068 -179.882 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -163.5 22.81 0.18 Allowed Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.62 180.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.522 ' HA ' ' CE ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -128.95 144.82 51.3 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.798 0.332 . . . . 0.0 110.969 179.797 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 4.2 t-160 -119.66 85.42 2.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.302 -179.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.526 ' CE2' ' CG ' ' A' ' 34' ' ' TRP . 96.6 m-85 -85.01 166.3 16.83 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.833 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.514 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 0.0 OUTLIER -91.86 149.4 21.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.608 179.705 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.516 ' CG2' ' O ' ' A' ' 48' ' ' TYR . 3.8 mp -41.58 147.14 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 120.851 0.357 . . . . 0.0 111.191 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.481 ' N ' HG21 ' A' ' 30' ' ' ILE . 70.4 m-20 67.17 11.47 8.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.301 179.813 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.514 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 10.2 tp60 -99.24 145.06 27.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.799 0.333 . . . . 0.0 110.613 179.66 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -112.63 156.51 22.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.173 -179.714 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . 0.553 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 48.9 p90 -160.87 173.99 14.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.887 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.437 ' HG3' ' O ' ' A' ' 43' ' ' LEU . 0.1 OUTLIER -99.92 141.78 32.29 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.113 -179.823 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.52 ' O ' ' N ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -140.36 169.81 16.98 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.724 179.886 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -137.45 125.76 23.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.769 -179.762 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.422 ' HB2' HD22 ' A' ' 43' ' ' LEU . 6.1 t80 -119.6 136.84 54.2 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.681 179.718 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 2.4 tp 64.24 13.1 7.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.693 -179.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 85.71 29.65 26.03 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.933 -0.651 . . . . 0.0 112.743 179.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -133.39 145.67 50.54 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.784 0.326 . . . . 0.0 111.027 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.41 ' O ' HD11 ' A' ' 43' ' ' LEU . . . -43.75 151.29 0.21 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.64 179.768 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.52 ' N ' ' O ' ' A' ' 36' ' ' ARG . 4.4 tp -170.24 165.59 8.96 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.951 0.405 . . . . 0.0 111.379 -179.615 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.484 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 17.7 t -132.31 151.97 35.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.398 179.459 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.553 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 0.5 OUTLIER -129.26 153.56 47.67 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.903 0.382 . . . . 0.0 111.423 -179.564 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 69.4 m -138.4 131.96 30.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.757 179.715 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.478 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 21.0 t -92.86 161.5 14.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.042 -179.728 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.516 ' O ' ' CG2' ' A' ' 30' ' ' ILE . 36.8 m-85 -138.62 -43.99 0.49 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.771 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.424 ' CA ' HG23 ' A' ' 30' ' ' ILE . . . 104.2 167.67 24.89 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.469 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 65.95 -113.38 5.7 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.613 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -104.29 -24.65 13.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.783 0.325 . . . . 0.0 110.992 -179.875 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.461 ' HB3' ' HB2' ' A' ' 48' ' ' TYR . 0.1 OUTLIER -54.99 -36.33 65.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.847 -179.952 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 63.48 -103.89 0.75 Allowed Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.549 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.552 ' CE1' ' SG ' ' A' ' 45' ' ' CYS . 1.4 p90 -158.58 166.69 31.51 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.854 0.359 . . . . 0.0 111.002 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -149.07 112.23 4.92 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.658 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.484 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.6 OUTLIER -83.4 170.93 13.99 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.121 -179.752 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 171.99 178.78 0.07 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.965 -179.879 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.408 ' HA ' HD12 ' A' ' 43' ' ' LEU . 1.3 p -59.36 173.42 0.51 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.018 -179.975 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.88 84.34 38.28 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.045 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_exo -55.89 98.33 0.06 OUTLIER 'Trans proline' 0 C--O 1.231 0.152 0 C-N-CA 122.846 2.364 . . . . 0.0 112.338 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.523 ' O ' ' CG ' ' A' ' 61' ' ' GLU . 8.1 tt0 -117.41 65.69 0.73 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.902 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.438 ' O ' ' O ' ' A' ' 61' ' ' GLU . . . 42.13 -169.15 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.111 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -100.83 -28.04 13.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.575 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.458 ' HG2' ' HG2' ' A' ' 76' ' ' ARG . 0.0 OUTLIER -92.01 117.18 29.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.894 -179.919 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -171.23 163.94 7.18 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.239 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 175.86 171.65 0.36 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.876 -180.0 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -179.28 94.0 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.963 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . 0.571 ' HB2' ' CE2' ' A' ' 75' ' ' TYR . 38.7 t0 -69.02 81.65 0.31 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.731 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 7.3 pttm -41.75 -31.31 0.29 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.907 -179.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 8.0 m-30 -51.64 -27.36 11.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.759 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 24.0 p -137.7 -54.47 0.67 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.087 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 126.98 4.06 6.14 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.56 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . 0.506 ' HB3' ' CE1' ' A' ' 75' ' ' TYR . 2.2 m120 -70.95 149.29 46.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.835 0.35 . . . . 0.0 110.943 -179.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 91.7 m -103.54 117.11 33.69 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.992 179.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.571 ' CE2' ' HB2' ' A' ' 68' ' ' ASP . 6.5 m-85 -105.79 -160.51 0.75 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.806 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . 0.458 ' HG2' ' HG2' ' A' ' 64' ' ' GLU . 0.0 OUTLIER -142.05 133.35 26.4 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.721 179.839 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 55.0 t -49.97 -26.21 2.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.166 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -89.12 21.79 26.07 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.418 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -145.95 135.05 22.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.801 0.334 . . . . 0.0 111.083 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 3.2 p -107.2 171.92 7.11 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.176 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 49.0 p90 -165.28 150.11 9.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.869 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -87.47 133.31 33.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.08 -179.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 20.3 ttp180 -132.95 73.02 76.21 Favored Pre-proline 0 C--N 1.327 -0.385 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.708 179.712 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_exo -46.5 152.34 1.54 Allowed 'Trans proline' 0 C--N 1.342 0.219 0 C-N-CA 122.797 2.332 . . . . 0.0 112.589 -179.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 5.7 tptp -178.77 160.34 1.15 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.822 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 54.03 35.6 22.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.921 -179.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.9 m 60.8 48.17 7.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.868 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -169.68 160.51 8.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.823 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 2.5 mp -100.12 133.66 42.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.983 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . 0.524 ' N ' ' CD1' ' A' ' 90' ' ' TRP . 1.4 m95 -134.77 112.78 11.02 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.93 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -68.36 80.99 0.25 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.917 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . 0.421 ' HA ' ' HA ' ' A' ' 104' ' ' CYS . 0.6 OUTLIER -54.85 178.79 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.896 179.938 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 97.5 m -157.23 131.2 8.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.095 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 9.2 t -72.25 74.71 0.98 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 -179.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.542 ' CG2' ' CA ' ' A' ' 100' ' ' GLY . 1.0 OUTLIER -78.77 115.64 21.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.369 -179.94 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -149.45 97.5 0.18 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.512 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -159.59 61.26 0.38 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.859 0.361 . . . . 0.0 110.994 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . 0.489 ' O ' ' CB ' ' A' ' 99' ' ' ARG . . . 72.28 8.94 71.66 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.54 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.489 ' CB ' ' O ' ' A' ' 98' ' ' GLY . 0.0 OUTLIER 161.24 45.56 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.904 0.383 . . . . 0.0 111.012 -179.985 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . 0.542 ' CA ' ' CG2' ' A' ' 95' ' ' ILE . . . -89.58 -52.61 2.62 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.386 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.484 ' CD ' ' O ' ' A' ' 100' ' ' GLY . 0.0 OUTLIER 48.56 105.7 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.816 0.341 . . . . 0.0 111.107 179.926 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . 0.42 ' C ' ' O ' ' A' ' 101' ' ' ARG . 3.6 mp -36.92 130.82 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.922 179.755 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.4 ' O ' ' HA ' ' A' ' 92' ' ' CYS . 13.2 t -127.66 159.96 33.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.047 -179.785 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.421 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 0.5 OUTLIER -134.15 127.45 32.07 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.801 179.94 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' THR . . . . . 0.453 ' CG2' ' O ' ' A' ' 105' ' ' THR . 4.8 t -148.15 121.15 8.81 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.271 -179.86 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.463 HG13 ' CE3' ' A' ' 90' ' ' TRP . 2.7 mt -44.15 151.06 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.056 179.902 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.426 ' N ' HG22 ' A' ' 106' ' ' ILE . . . -88.15 122.81 32.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.14 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -60.4 145.8 46.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.969 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 2.9 ttp180 . . . . . 0 C--O 1.25 1.088 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.893 179.984 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 6.4 t . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 120.898 0.38 . . . . 0.0 111.165 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 176.35 141.04 0.22 Allowed Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.894 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -68.38 -163.23 0.09 OUTLIER 'Trans proline' 0 N--CA 1.465 -0.172 0 C-N-CA 122.654 2.236 . . . . 0.0 112.12 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.41 ' CA ' HD13 ' A' ' 30' ' ' ILE . . . 101.45 137.62 9.81 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.474 -179.911 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.423 ' O ' ' CD2' ' A' ' 27' ' ' HIS . 2.0 m -84.23 151.25 24.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.781 0.324 . . . . 0.0 110.854 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 82.7 t80 -157.61 109.95 2.39 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.907 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.449 ' OD1' ' N ' ' A' ' 24' ' ' ASN . 38.8 t0 -151.48 157.85 42.86 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.923 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.449 ' N ' ' OD1' ' A' ' 23' ' ' ASP . 4.5 t-20 56.54 26.43 11.0 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.932 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 76.17 7.35 84.49 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.465 179.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.426 ' HB3' ' CE2' ' A' ' 28' ' ' TYR . 0.1 OUTLIER -116.02 141.38 48.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.856 0.36 . . . . 0.0 110.897 179.946 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . 0.423 ' CD2' ' O ' ' A' ' 21' ' ' CYS . 3.3 t-160 -113.58 89.29 3.05 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.041 -179.911 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.426 ' CE2' ' HB3' ' A' ' 26' ' ' LYS . 94.8 m-85 -87.17 145.19 26.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.806 179.899 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.511 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 10.4 tt0 -62.97 151.68 38.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.091 179.629 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.468 ' HA ' ' SG ' ' A' ' 47' ' ' CYS . 19.8 mm -50.56 144.28 2.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.935 0.397 . . . . 0.0 110.827 -179.779 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.461 ' HB2' ' O ' ' A' ' 30' ' ' ILE . 5.4 m-20 71.23 3.74 4.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.121 -179.808 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.511 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 29.7 tp60 -80.01 151.14 30.14 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.709 179.582 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.486 ' CG ' HG21 ' A' ' 46' ' ' THR . 25.2 mt-30 -115.37 142.78 46.23 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.783 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . 0.405 ' CZ3' ' HB2' ' A' ' 47' ' ' CYS . 40.6 p90 -145.45 171.3 14.84 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.943 0.401 . . . . 0.0 111.072 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 13.8 tm-20 -100.66 140.28 35.16 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.227 -179.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -137.18 -167.89 2.19 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.362 179.714 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.559 ' CG2' ' N ' ' A' ' 38' ' ' TYR . 1.8 t -151.2 -51.77 0.13 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.679 0.276 . . . . 0.0 111.55 179.791 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.559 ' N ' ' CG2' ' A' ' 37' ' ' THR . 18.4 t80 44.86 104.97 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.267 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.486 ' CB ' ' O ' ' A' ' 38' ' ' TYR . 1.7 tp 82.77 15.56 0.37 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.779 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 66.13 51.68 42.65 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.81 -0.709 . . . . 0.0 112.717 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.478 ' O ' ' HA ' ' A' ' 37' ' ' THR . 62.2 m-80 -150.95 129.28 12.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.609 0.242 . . . . 0.0 110.983 179.866 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.429 ' C ' ' O ' ' A' ' 41' ' ' ASN . . . -32.96 119.43 0.32 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.032 179.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.471 HD21 ' HB3' ' A' ' 38' ' ' TYR . 15.0 tp -145.13 146.19 31.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.208 -179.529 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.474 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 4.1 t -130.62 139.07 52.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.551 179.659 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.517 ' SG ' ' CD1' ' A' ' 54' ' ' PHE . 0.4 OUTLIER -123.84 150.45 44.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.291 -179.626 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.545 ' O ' ' CE1' ' A' ' 48' ' ' TYR . 24.1 m -134.74 118.64 17.31 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.85 179.803 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.468 ' SG ' ' HA ' ' A' ' 30' ' ' ILE . 38.1 t -71.01 152.96 43.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.977 0.418 . . . . 0.0 110.932 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.545 ' CE1' ' O ' ' A' ' 46' ' ' THR . 5.3 m-85 -125.78 -31.26 2.94 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.133 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.468 ' HA2' HD12 ' A' ' 30' ' ' ILE . . . 89.55 179.01 45.14 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.5 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 52.73 -113.63 2.91 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.469 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 5.9 m -111.33 -23.74 10.62 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.818 0.342 . . . . 0.0 110.939 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.452 ' HB2' ' HB2' ' A' ' 48' ' ' TYR . 55.8 mtm180 -50.76 -39.42 52.3 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.873 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . 0.445 ' O ' ' N ' ' A' ' 48' ' ' TYR . . . 70.53 -131.84 22.16 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.665 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.517 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 3.6 p90 -146.97 162.65 38.31 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.876 0.369 . . . . 0.0 110.961 -179.873 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.458 ' HB3' ' OH ' ' A' ' 48' ' ' TYR . 2.2 t30 -143.06 126.43 16.67 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.696 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.474 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 2.0 m -87.19 166.66 14.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.101 -179.864 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.473 ' CG ' ' C ' ' A' ' 56' ' ' CYS . 0.0 OUTLIER -171.32 135.58 0.96 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.901 -179.934 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.425 ' HA ' ' O ' ' A' ' 42' ' ' ALA . 0.1 OUTLIER -50.01 140.17 12.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.053 -179.99 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -48.4 131.53 13.26 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.783 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.463 ' O ' ' HB3' ' A' ' 61' ' ' GLU . 34.9 Cg_endo -65.26 178.46 2.01 Favored 'Trans proline' 0 C--O 1.232 0.175 0 C-N-CA 122.706 2.271 . . . . 0.0 112.284 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.493 ' O ' ' CG ' ' A' ' 61' ' ' GLU . 5.3 tm-20 66.49 12.68 8.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.857 -179.875 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.465 ' O ' ' O ' ' A' ' 61' ' ' GLU . . . 51.29 169.21 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.153 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -119.94 125.35 48.23 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.614 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.451 ' O ' ' O ' ' A' ' 65' ' ' THR . 0.0 OUTLIER -176.97 161.34 1.93 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.033 -179.969 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.465 ' O ' ' HA ' ' A' ' 97' ' ' ALA . 2.8 p 46.14 -177.84 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.308 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 24.7 p -175.14 162.7 3.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.788 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.487 ' CB ' ' HA2' ' A' ' 98' ' ' GLY . 82.3 t80 -117.97 126.24 51.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.042 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -82.05 105.22 12.97 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.748 179.83 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.64 -1.21 17.96 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.162 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 3.8 m-30 -94.32 -25.13 17.13 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.843 0.354 . . . . 0.0 110.862 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 1.1 p -142.45 -47.96 0.34 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.226 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 113.75 39.99 1.04 Allowed Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.454 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . 0.475 ' HB3' ' CZ ' ' A' ' 75' ' ' TYR . 0.8 OUTLIER -113.1 120.28 40.76 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.803 0.335 . . . . 0.0 110.788 -179.968 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 41.7 m -69.28 128.51 36.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.013 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.475 ' CZ ' ' HB3' ' A' ' 73' ' ' ASN . 62.1 m-85 -130.97 -171.6 2.61 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.788 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 23.0 mtp85 -103.49 134.8 46.24 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.736 179.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 9.0 p -57.46 -22.98 18.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.138 -179.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -92.52 23.48 27.73 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.486 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -142.64 128.19 19.07 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.882 0.372 . . . . 0.0 110.886 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.491 ' OG1' ' N ' ' A' ' 81' ' ' TYR . 0.1 OUTLIER -101.29 176.1 5.36 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.061 179.993 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.491 ' N ' ' OG1' ' A' ' 80' ' ' THR . 33.8 p90 -154.41 138.25 16.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.861 -179.873 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -69.96 136.57 50.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.006 0.432 . . . . 0.0 110.857 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.427 ' HD3' ' HA ' ' A' ' 83' ' ' ARG . 0.0 OUTLIER -154.14 93.83 2.9 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.83 -179.935 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -66.82 166.74 21.5 Favored 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.737 2.292 . . . . 0.0 112.282 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 178.45 158.73 0.51 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.888 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 38.7 t0 59.28 -89.71 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.861 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 10.4 p -156.34 25.37 0.35 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.942 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' MET . . . . . 0.448 ' O ' ' CD1' ' A' ' 90' ' ' TRP . 0.0 OUTLIER -154.15 152.61 30.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.985 -179.926 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 7.9 mt -92.07 130.6 40.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.054 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . 0.573 ' CE3' HG13 ' A' ' 106' ' ' ILE . 0.8 OUTLIER -128.38 129.93 46.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.883 -179.944 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -83.49 69.91 10.14 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.923 179.925 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . 0.453 ' HA ' ' O ' ' A' ' 103' ' ' SER . 0.8 OUTLIER -44.2 127.19 5.49 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.03 -179.954 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.507 ' O ' ' N ' ' A' ' 95' ' ' ILE . 6.0 m -105.59 120.64 42.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.985 179.815 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -58.38 77.63 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.949 -179.859 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.507 ' N ' ' O ' ' A' ' 93' ' ' THR . 1.8 mt -89.87 131.59 36.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.259 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 115.38 -142.29 17.51 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.539 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.465 ' HA ' ' O ' ' A' ' 65' ' ' THR . . . -163.27 43.76 0.11 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.864 0.364 . . . . 0.0 110.939 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . 0.487 ' HA2' ' CB ' ' A' ' 67' ' ' PHE . . . 93.43 12.6 57.0 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.537 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -167.77 38.05 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.818 0.342 . . . . 0.0 111.01 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . 0.419 ' O ' ' HB3' ' A' ' 101' ' ' ARG . . . -118.96 -91.67 1.4 Allowed Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.491 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.419 ' HB3' ' O ' ' A' ' 100' ' ' GLY . 0.0 OUTLIER 168.49 109.67 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.867 0.365 . . . . 0.0 110.875 -179.969 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . 0.477 HD13 ' N ' ' A' ' 102' ' ' ILE . 1.2 mm -69.69 74.64 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.153 -179.971 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.453 ' O ' ' HA ' ' A' ' 92' ' ' CYS . 13.4 t -41.99 156.56 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.893 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.451 ' SG ' ' HB2' ' A' ' 90' ' ' TRP . 0.0 OUTLIER -138.7 97.25 3.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.902 -179.943 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 4.5 t -103.88 135.57 45.16 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.158 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.573 HG13 ' CE3' ' A' ' 90' ' ' TRP . 2.5 mp -48.99 145.07 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.011 179.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -71.35 98.43 1.77 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.086 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -137.2 136.37 38.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.909 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 5.5 mtt-85 . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.18 -0.914 . . . . 0.0 110.889 179.91 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.375 0 CA-C-O 120.758 0.313 . . . . 0.0 111.181 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 8.9 mttt -116.88 144.94 34.42 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.975 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -69.95 152.2 68.23 Favored 'Trans proline' 0 N--CA 1.464 -0.209 0 C-N-CA 122.718 2.279 . . . . 0.0 112.271 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.462 ' HA2' HG13 ' A' ' 30' ' ' ILE . . . 106.77 -164.05 13.36 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.538 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.517 ' O ' ' CD2' ' A' ' 27' ' ' HIS . 0.2 OUTLIER -155.45 155.49 33.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.794 0.33 . . . . 0.0 110.845 -179.972 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -142.65 130.59 21.75 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.817 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.41 ' O ' ' N ' ' A' ' 26' ' ' LYS . 1.4 t0 -161.73 144.25 11.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.136 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.414 ' ND2' ' HE2' ' A' ' 26' ' ' LYS . 0.8 OUTLIER 44.81 28.79 0.38 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.232 179.782 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 85.25 -10.34 63.99 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.762 179.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.414 ' HE2' ' ND2' ' A' ' 24' ' ' ASN . 0.9 OUTLIER -89.85 140.37 29.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.872 0.367 . . . . 0.0 110.787 179.979 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . 0.517 ' CD2' ' O ' ' A' ' 21' ' ' CYS . 14.9 t-80 -120.1 92.34 3.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.257 -179.757 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.434 ' CE2' ' CD1' ' A' ' 34' ' ' TRP . 0.1 OUTLIER -83.43 165.24 19.38 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.765 179.713 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.526 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 8.7 tt0 -94.9 145.19 25.08 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.837 179.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.462 HG13 ' HA2' ' A' ' 20' ' ' GLY . 3.7 mp -48.91 150.81 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.349 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.402 ' N ' ' O ' ' A' ' 47' ' ' CYS . 78.8 m-20 59.84 17.24 6.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.125 179.74 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.526 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 1.1 tt0 -102.88 154.35 19.29 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.838 0.351 . . . . 0.0 110.934 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -120.32 138.71 53.55 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.901 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . 0.537 ' CZ3' ' HB2' ' A' ' 47' ' ' CYS . 31.3 p90 -146.36 -176.93 5.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.871 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -108.79 123.46 49.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.024 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.518 ' O ' ' CB ' ' A' ' 43' ' ' LEU . 0.5 OUTLIER -131.75 167.6 19.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.603 179.766 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.402 ' OG1' ' C ' ' A' ' 41' ' ' ASN . 1.6 t -134.23 137.11 44.11 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.919 179.836 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.488 ' O ' ' CB ' ' A' ' 39' ' ' LEU . 22.1 t80 -107.74 108.54 19.81 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.874 -179.837 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.488 ' CB ' ' O ' ' A' ' 38' ' ' TYR . 6.7 tp 82.36 -49.24 0.19 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.821 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 165.16 36.94 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.795 -0.716 . . . . 0.0 112.51 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.424 ' O ' ' C ' ' A' ' 42' ' ' ALA . 68.9 m-80 -141.08 128.78 21.55 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 120.735 0.303 . . . . 0.0 111.053 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.478 ' O ' ' CD1' ' A' ' 43' ' ' LEU . . . -36.16 150.94 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.908 179.856 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.518 ' CB ' ' O ' ' A' ' 36' ' ' ARG . 1.4 tp -167.64 153.6 7.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.906 0.384 . . . . 0.0 111.275 -179.734 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.496 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.3 t -119.81 123.03 70.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.192 179.35 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.492 ' HB2' ' CE2' ' A' ' 34' ' ' TRP . 85.2 m -104.15 159.1 15.97 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.636 -179.141 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.473 ' O ' ' CE1' ' A' ' 48' ' ' TYR . 6.6 m -140.36 116.6 10.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.712 179.639 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.537 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 6.4 t -82.33 133.7 35.24 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.228 -179.569 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.473 ' CE1' ' O ' ' A' ' 46' ' ' THR . 7.1 m-85 -117.38 -27.08 6.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.629 179.864 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 138.67 174.14 13.31 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.227 -179.807 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -75.34 64.62 2.45 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.439 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -173.02 -64.29 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.792 0.33 . . . . 0.0 111.003 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -67.39 -24.95 65.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.242 -179.773 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 70.97 134.79 0.11 Allowed Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.216 -179.746 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.57 ' CD1' ' O ' ' A' ' 54' ' ' PHE . 4.8 p90 -69.98 132.66 46.26 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.942 0.401 . . . . 0.0 111.304 -179.692 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -108.39 140.54 41.53 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.237 179.542 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.496 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 2.4 m -126.63 176.01 7.53 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.992 0.425 . . . . 0.0 111.491 -179.529 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 177.52 -171.57 0.1 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.73 -179.912 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -56.9 141.71 44.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.952 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -73.16 119.27 74.81 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.965 179.929 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_exo -46.58 145.42 6.35 Favored 'Trans proline' 0 N--CA 1.464 -0.221 0 C-N-CA 122.722 2.281 . . . . 0.0 112.3 179.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.28 -30.87 70.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.827 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -135.04 153.65 51.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.967 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -111.84 -56.35 2.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.573 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.459 ' O ' ' OG1' ' A' ' 65' ' ' THR . 0.0 OUTLIER 171.49 176.4 0.07 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.999 179.976 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.459 ' OG1' ' O ' ' A' ' 64' ' ' GLU . 17.5 p 60.86 -177.65 0.11 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.224 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 20.2 t 176.2 129.17 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.854 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.544 ' CE1' ' HA ' ' A' ' 69' ' ' LYS . 53.2 t80 -85.39 108.07 17.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.007 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . 0.464 ' O ' ' O ' ' A' ' 69' ' ' LYS . 1.2 t70 -81.34 85.75 6.37 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.737 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.544 ' HA ' ' CE1' ' A' ' 67' ' ' PHE . 0.3 OUTLIER -39.81 164.46 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.905 -179.941 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . 0.503 ' N ' ' CD1' ' A' ' 70' ' ' TYR . 2.0 m-30 83.95 -46.31 0.11 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.892 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -111.87 -42.04 3.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.131 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . 0.426 ' HA2' ' CE2' ' A' ' 67' ' ' PHE . . . 90.34 5.62 69.58 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.554 -179.963 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 65.9 m-80 -74.01 105.82 5.42 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.845 0.355 . . . . 0.0 110.906 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 26.5 m -54.43 118.03 3.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.013 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.476 ' CE2' ' HB3' ' A' ' 81' ' ' TYR . 17.2 m-30 -110.05 177.58 4.67 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.696 179.894 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . 0.434 ' HB2' ' HB2' ' A' ' 79' ' ' ASP . 0.6 OUTLIER -104.37 141.62 36.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.871 179.969 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.455 ' HA ' ' O ' ' A' ' 94' ' ' CYS . 9.0 p -47.8 -29.43 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.138 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.416 ' N ' HG12 ' A' ' 77' ' ' VAL . . . -105.8 14.39 45.57 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.499 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . 0.434 ' HB2' ' HB2' ' A' ' 76' ' ' ARG . 8.9 t70 -112.23 110.92 21.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.896 0.379 . . . . 0.0 110.887 -179.913 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.455 HG23 ' OG1' ' A' ' 93' ' ' THR . 2.7 p -81.89 150.46 27.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.158 179.983 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.476 ' HB3' ' CE2' ' A' ' 75' ' ' TYR . 11.6 p90 -123.17 -33.08 3.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.946 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.455 ' HB3' ' O ' ' A' ' 81' ' ' TYR . 30.7 tt0 76.44 165.75 0.25 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.92 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -172.39 107.57 0.35 Allowed Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.742 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo -68.94 89.6 0.44 Allowed 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.716 2.277 . . . . 0.0 112.352 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 10.3 mttt -111.54 137.06 49.87 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.919 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 68.24 9.01 6.96 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.004 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.0 p 69.97 13.19 7.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.947 179.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' MET . . . . . 0.405 ' O ' ' O ' ' A' ' 89' ' ' ILE . 0.0 OUTLIER -102.1 -23.32 14.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.96 -179.933 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.405 ' O ' ' O ' ' A' ' 88' ' ' MET . 2.9 mp 59.31 122.29 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.12 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . 0.508 ' O ' ' N ' ' A' ' 92' ' ' CYS . 4.5 m95 -131.94 109.74 10.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.959 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -57.77 79.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.663 179.82 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . 0.508 ' N ' ' O ' ' A' ' 90' ' ' TRP . 0.5 OUTLIER -82.65 152.51 25.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.069 -179.782 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.478 ' O ' ' N ' ' A' ' 95' ' ' ILE . 25.9 m -125.71 126.73 45.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.974 179.841 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . 0.463 ' HA ' HG21 ' A' ' 102' ' ' ILE . 0.3 OUTLIER -57.83 80.11 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.024 -179.896 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.478 ' N ' ' O ' ' A' ' 93' ' ' THR . 0.9 OUTLIER -97.57 141.43 15.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.199 179.975 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.419 ' HA3' ' HA3' ' A' ' 100' ' ' GLY . . . 127.36 162.74 11.23 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.436 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -96.94 57.92 1.55 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.78 0.324 . . . . 0.0 111.101 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . 0.48 ' O ' ' CB ' ' A' ' 99' ' ' ARG . . . 92.72 7.99 62.52 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.506 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.48 ' CB ' ' O ' ' A' ' 98' ' ' GLY . 0.0 OUTLIER 162.21 38.88 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.88 0.371 . . . . 0.0 110.836 -179.92 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . 0.441 ' C ' ' HG3' ' A' ' 101' ' ' ARG . . . -76.8 -86.96 0.37 Allowed Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.491 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.558 ' CD ' ' N ' ' A' ' 101' ' ' ARG . 0.0 OUTLIER -176.12 94.91 0.06 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.831 0.348 . . . . 0.0 110.996 179.875 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . 0.465 HD11 ' N ' ' A' ' 102' ' ' ILE . 2.4 mm -58.59 99.43 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.951 179.734 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.416 ' C ' ' SG ' ' A' ' 92' ' ' CYS . 1.4 t -73.06 125.51 27.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.128 -179.82 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.461 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 59.2 m -108.32 164.17 12.55 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.834 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 3.2 t -178.27 149.45 0.53 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.181 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.44 HG21 ' N ' ' A' ' 107' ' ' ALA . 5.0 mt -82.41 137.79 20.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.078 179.843 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.44 ' N ' HG21 ' A' ' 106' ' ' ILE . . . -158.18 150.47 22.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.133 179.99 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . 0.482 ' O ' ' CB ' ' A' ' 109' ' ' ARG . 8.7 t30 179.49 59.29 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.918 -179.998 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . 0.482 ' CB ' ' O ' ' A' ' 108' ' ' ASN . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.244 -0.884 . . . . 0.0 110.887 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 83.7 p . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.785 0.326 . . . . 0.0 111.149 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.34 67.67 7.59 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.943 -179.789 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.463 ' O ' HG13 ' A' ' 30' ' ' ILE . 35.1 Cg_exo -61.33 -158.13 0.02 OUTLIER 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.897 2.398 . . . . 0.0 112.33 -179.947 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.469 ' HA2' HG13 ' A' ' 30' ' ' ILE . . . -70.73 -148.78 0.5 Allowed Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.443 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 81.0 m -134.83 93.76 3.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.912 0.387 . . . . 0.0 110.956 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -47.91 147.89 1.85 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.023 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.43 ' O ' ' CG ' ' A' ' 24' ' ' ASN . 14.2 t0 -178.3 131.85 0.14 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.767 179.977 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.43 ' CG ' ' O ' ' A' ' 23' ' ' ASP . 10.1 p30 51.04 22.92 1.34 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.989 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 88.64 -10.18 73.1 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.508 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.402 ' HB3' ' CZ ' ' A' ' 28' ' ' TYR . 0.1 OUTLIER -92.56 131.29 37.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.795 0.331 . . . . 0.0 110.835 179.963 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 14.7 t-160 -113.87 91.08 3.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.145 -179.704 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.454 ' O ' ' HA3' ' A' ' 20' ' ' GLY . 0.5 OUTLIER -79.76 176.9 9.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.802 179.837 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.529 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 0.0 OUTLIER -91.11 148.11 22.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.953 -179.946 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.469 HG13 ' HA2' ' A' ' 20' ' ' GLY . 3.7 mp -48.07 148.76 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.298 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 11.6 m-20 62.79 15.54 8.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.197 179.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.529 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 15.1 tt0 -98.14 150.36 21.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.804 0.335 . . . . 0.0 110.727 179.864 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.524 ' HG2' ' CG2' ' A' ' 46' ' ' THR . 8.8 mt-30 -110.21 156.17 21.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.086 -179.737 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . 0.584 ' CH2' ' O ' ' A' ' 46' ' ' THR . 48.6 p90 -162.56 -170.9 2.55 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.76 179.603 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -112.39 132.82 54.81 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.41 -179.581 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.521 ' O ' ' N ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -134.17 -174.1 3.45 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.22 179.548 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.7 t -145.53 134.93 23.1 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.963 0.411 . . . . 0.0 111.312 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.448 ' CB ' HD23 ' A' ' 43' ' ' LEU . 1.6 t80 -128.95 122.75 30.85 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.597 179.696 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.443 ' CB ' ' O ' ' A' ' 38' ' ' TYR . 1.5 tp 78.85 8.71 1.96 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.663 -179.595 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 89.12 41.59 5.82 Favored Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.995 -0.622 . . . . 0.0 112.754 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.43 ' O ' ' C ' ' A' ' 42' ' ' ALA . 65.2 m-80 -152.14 136.85 17.01 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.681 0.277 . . . . 0.0 111.069 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.455 ' O ' HD13 ' A' ' 43' ' ' LEU . . . -37.08 152.25 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.643 179.659 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.521 ' N ' ' O ' ' A' ' 36' ' ' ARG . 2.6 tp -167.15 156.56 10.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.02 0.438 . . . . 0.0 111.535 -179.537 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.493 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 15.2 t -110.09 155.54 11.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.693 178.927 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.574 ' SG ' ' CD1' ' A' ' 54' ' ' PHE . 0.1 OUTLIER -161.22 174.02 14.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.112 0.482 . . . . 0.0 111.6 -179.502 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.584 ' O ' ' CH2' ' A' ' 34' ' ' TRP . 0.2 OUTLIER -138.79 -167.58 2.24 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.746 179.878 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.492 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 46.4 t -134.82 140.45 45.86 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.94 0.4 . . . . 0.0 111.019 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -110.54 -36.94 5.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.776 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.478 ' O ' ' N ' ' A' ' 51' ' ' SER . . . 127.18 163.66 11.49 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.406 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . 0.42 ' C ' ' O ' ' A' ' 49' ' ' GLY . . . 36.1 29.86 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.693 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.478 ' N ' ' O ' ' A' ' 49' ' ' GLY . 0.1 OUTLIER 49.65 35.24 8.35 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.86 0.362 . . . . 0.0 111.006 179.935 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.467 ' HG3' ' O ' ' A' ' 49' ' ' GLY . 9.7 mtp85 -58.83 -51.91 67.97 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.723 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 156.83 89.75 0.07 OUTLIER Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.613 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.574 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 1.8 p90 -58.17 -172.03 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.836 0.35 . . . . 0.0 110.813 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -136.13 114.09 11.29 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.76 179.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.493 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 13.3 m -94.61 -178.64 4.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.01 -179.855 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.426 ' O ' ' CD1' ' A' ' 43' ' ' LEU . 0.1 OUTLIER -171.95 -92.29 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.023 -179.996 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.464 ' HA ' ' HA ' ' A' ' 43' ' ' LEU . 0.2 OUTLIER 175.81 -177.16 0.12 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.914 -179.91 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 1.3 mmmt -90.87 159.51 40.14 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.915 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -49.01 177.49 0.02 OUTLIER 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.807 2.338 . . . . 0.0 112.339 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -138.68 18.0 2.69 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.812 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -123.05 117.4 25.36 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.004 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -88.07 107.64 18.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.635 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.449 ' O ' HG22 ' A' ' 65' ' ' THR . 17.4 tt0 -177.29 39.54 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.889 179.969 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.449 HG22 ' O ' ' A' ' 64' ' ' GLU . 7.1 p -146.7 -166.16 2.42 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.129 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.453 ' O ' ' HB3' ' A' ' 67' ' ' PHE . 0.0 OUTLIER -157.02 -63.66 0.1 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.888 -179.934 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.458 ' CE1' ' HA ' ' A' ' 69' ' ' LYS . 24.3 t80 79.76 92.25 0.05 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.806 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . 0.452 ' O ' ' HG2' ' A' ' 69' ' ' LYS . 0.6 OUTLIER -88.69 44.4 1.2 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.988 -179.96 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.581 ' HG3' ' CD1' ' A' ' 70' ' ' TYR . 2.2 ptmt 36.16 -144.52 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.728 179.836 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . 0.581 ' CD1' ' HG3' ' A' ' 69' ' ' LYS . 9.4 m-30 79.95 -50.33 0.37 Allowed 'General case' 0 C--O 1.231 0.129 0 CA-C-O 120.722 0.296 . . . . 0.0 110.854 -179.687 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.478 HG22 ' N ' ' A' ' 72' ' ' GLY . 5.3 t -171.37 -35.88 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.26 179.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . 0.478 ' N ' HG22 ' A' ' 71' ' ' THR . . . 141.41 55.88 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.554 -179.861 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 24.0 m-80 -104.44 49.53 0.81 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.738 0.304 . . . . 0.0 110.963 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.412 ' O ' HG22 ' A' ' 74' ' ' THR . 4.5 t -43.0 128.19 4.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.128 179.96 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.489 ' CE2' ' CE2' ' A' ' 81' ' ' TYR . 52.3 m-85 -108.06 -179.93 4.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.941 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 2.8 tpp180 -112.65 132.15 55.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.829 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.522 HG22 ' CB ' ' A' ' 97' ' ' ALA . 11.7 p -54.18 -19.5 3.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.091 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -111.7 34.96 4.96 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.529 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -154.1 125.62 7.53 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.888 0.375 . . . . 0.0 111.022 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 58.8 p -78.5 168.24 20.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.04 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.506 ' CZ ' ' CB ' ' A' ' 92' ' ' CYS . 22.3 p90 -166.38 167.47 15.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.859 -179.891 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.413 ' HB3' ' HA ' ' A' ' 91' ' ' ASP . 0.0 OUTLIER -138.99 132.45 30.25 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.849 179.89 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.422 ' HD2' ' OH ' ' A' ' 75' ' ' TYR . 3.3 mtp180 -136.2 140.91 34.26 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.023 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_endo -77.78 124.32 6.81 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.853 2.369 . . . . 0.0 112.327 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.535 ' O ' ' CB ' ' A' ' 86' ' ' ASP . 12.4 tppt? -129.27 108.37 10.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.879 179.845 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.535 ' CB ' ' O ' ' A' ' 85' ' ' LYS . 6.7 t0 87.86 -35.18 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.03 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' SER . . . . . 0.5 ' CB ' ' O ' ' A' ' 86' ' ' ASP . 0.4 OUTLIER 159.02 -23.33 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.771 -179.999 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -98.32 154.84 17.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.875 -179.889 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 14.0 mt -106.05 135.0 46.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.072 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . 0.611 ' N ' ' CD1' ' A' ' 90' ' ' TRP . 0.1 OUTLIER -130.23 130.78 45.07 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.832 179.955 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.413 ' HA ' ' HB3' ' A' ' 82' ' ' GLU . 60.2 m-20 -72.58 62.41 0.55 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.942 -179.878 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . 0.506 ' CB ' ' CZ ' ' A' ' 81' ' ' TYR . 57.1 m -48.91 145.23 4.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.0 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.445 ' O ' ' N ' ' A' ' 95' ' ' ILE . 10.6 m -132.15 125.42 31.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.038 179.843 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 45.3 t -61.59 77.87 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.854 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.445 ' N ' ' O ' ' A' ' 93' ' ' THR . 1.5 mt -90.75 84.55 2.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.307 -179.84 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 157.1 -23.4 0.46 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.455 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.522 ' CB ' HG22 ' A' ' 77' ' ' VAL . . . 59.56 44.09 15.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.855 0.36 . . . . 0.0 111.042 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 159.63 -55.69 0.34 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.528 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 178.99 44.65 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.809 0.337 . . . . 0.0 110.973 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -74.61 -64.81 2.28 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.489 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.512 ' O ' ' N ' ' A' ' 103' ' ' SER . 1.5 ptt180 -177.7 62.79 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.725 0.298 . . . . 0.0 110.94 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . 0.411 ' C ' ' O ' ' A' ' 101' ' ' ARG . 13.2 mt -36.15 91.94 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.135 -179.93 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.512 ' N ' ' O ' ' A' ' 101' ' ' ARG . 0.3 OUTLIER -74.23 145.98 43.67 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.815 179.986 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 29.7 m -146.27 137.78 24.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.828 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 3.4 t -143.1 127.19 17.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.15 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.57 HG13 ' CE3' ' A' ' 90' ' ' TRP . 3.0 mt -41.6 126.01 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.033 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -107.49 105.78 15.85 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.07 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . 0.503 ' O ' ' CB ' ' A' ' 109' ' ' ARG . 4.6 m-20 -69.02 82.1 0.31 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.904 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . 0.503 ' CB ' ' O ' ' A' ' 108' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.195 -0.907 . . . . 0.0 110.9 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.402 0 CA-C-O 120.841 0.353 . . . . 0.0 111.112 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.65 94.53 31.91 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.937 -179.907 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -81.48 123.72 4.45 Favored 'Trans proline' 0 N--CA 1.462 -0.356 0 C-N-CA 122.901 2.401 . . . . 0.0 112.419 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.446 ' HA2' HG13 ' A' ' 30' ' ' ILE . . . 126.86 -173.88 18.26 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.682 -0.771 . . . . 0.0 112.611 179.934 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 3.3 m -145.91 91.76 2.12 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.852 0.358 . . . . 0.0 110.779 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -57.3 129.59 42.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.003 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.455 ' OD2' ' CE2' ' A' ' 54' ' ' PHE . 0.4 OUTLIER -161.65 135.17 6.47 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.82 179.98 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.424 ' O ' ' CG ' ' A' ' 24' ' ' ASN . 36.3 t30 62.28 38.96 12.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.865 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 60.47 17.45 47.72 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.622 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.572 ' HB3' ' CE1' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -133.05 137.82 46.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.848 0.356 . . . . 0.0 110.949 -179.985 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 51.9 t-80 -105.38 96.87 6.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.834 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.572 ' CE1' ' HB3' ' A' ' 26' ' ' LYS . 10.4 m-30 -79.68 170.54 16.38 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.804 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.464 ' O ' ' HB2' ' A' ' 32' ' ' GLN . 4.8 tm0? -89.93 130.98 36.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.504 179.742 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.472 ' HA ' ' SG ' ' A' ' 47' ' ' CYS . 4.3 mp -33.99 148.22 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.924 0.393 . . . . 0.0 111.383 -179.845 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.439 ' HB2' ' O ' ' A' ' 30' ' ' ILE . 34.1 m-20 76.47 4.53 3.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.847 -179.672 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.464 ' HB2' ' O ' ' A' ' 29' ' ' GLN . 7.2 tp60 -91.08 134.38 34.56 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.582 179.712 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.449 ' O ' ' NE2' ' A' ' 32' ' ' GLN . 20.9 mt-30 -103.17 148.31 25.93 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.034 -179.792 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . 0.534 ' CZ2' ' HB3' ' A' ' 45' ' ' CYS . 35.5 p90 -157.28 179.01 9.67 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.672 179.886 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -118.54 122.16 42.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.904 0.383 . . . . 0.0 111.377 -179.551 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.528 ' O ' ' CD2' ' A' ' 43' ' ' LEU . 3.8 ttt85 -114.59 141.53 47.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.528 179.592 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.532 ' CG2' ' N ' ' A' ' 38' ' ' TYR . 1.4 m -102.03 162.35 12.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.037 -179.782 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.532 ' N ' ' CG2' ' A' ' 37' ' ' THR . 13.0 t80 177.02 115.26 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.754 179.947 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.513 ' O ' ' ND2' ' A' ' 41' ' ' ASN . 0.8 OUTLIER 74.66 34.43 0.74 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.831 -179.864 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 68.04 30.55 74.08 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.43 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.513 ' ND2' ' O ' ' A' ' 39' ' ' LEU . 22.6 m-80 -134.12 146.0 49.84 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 120.837 0.351 . . . . 0.0 110.962 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.426 ' C ' HD13 ' A' ' 43' ' ' LEU . . . -100.08 112.34 24.63 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.999 179.896 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.596 ' N ' ' CD1' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -112.81 143.41 44.1 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.013 -179.989 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.486 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.7 t -93.7 126.9 46.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.348 179.261 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.57 ' SG ' ' CE1' ' A' ' 54' ' ' PHE . 6.2 m -105.64 166.94 10.1 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.698 -179.207 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.449 ' O ' ' HA ' ' A' ' 54' ' ' PHE . 26.0 m -150.49 124.47 9.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.679 179.642 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.472 ' SG ' ' HA ' ' A' ' 30' ' ' ILE . 15.1 t -79.79 130.39 35.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.032 -179.712 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -111.97 -25.59 9.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.93 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 94.58 -179.14 37.13 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.451 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 42.59 -129.69 5.0 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.59 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -89.33 -27.97 20.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.825 0.345 . . . . 0.0 110.979 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -49.69 -29.52 7.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.964 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 50.11 -125.37 19.95 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.629 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.57 ' CE1' ' SG ' ' A' ' 45' ' ' CYS . 1.1 p90 -132.85 160.2 37.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.829 0.347 . . . . 0.0 110.902 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -138.23 85.47 2.1 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.713 179.79 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.486 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.1 OUTLIER -63.3 158.9 19.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.045 -179.741 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -137.65 -70.13 0.44 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.844 179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.469 ' HA ' ' HA ' ' A' ' 43' ' ' LEU . 85.0 p -172.59 176.86 3.12 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.822 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 46.3 tptt -102.62 101.53 20.91 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.78 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.459 ' HD3' ' O ' ' A' ' 58' ' ' SER . 53.2 Cg_exo -52.15 104.26 0.09 OUTLIER 'Trans proline' 0 C--N 1.342 0.21 0 C-N-CA 122.697 2.265 . . . . 0.0 112.361 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -38.26 -74.27 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.757 179.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -131.77 138.82 48.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.962 179.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.422 ' O ' ' N ' ' A' ' 65' ' ' THR . 1.3 tt0 -85.83 -47.12 10.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.43 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 87.9 mt-10 -62.33 78.59 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.806 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.422 ' N ' ' O ' ' A' ' 63' ' ' GLU . 7.3 p -142.45 150.67 40.88 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.189 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.411 ' SG ' ' HB2' ' A' ' 75' ' ' TYR . 0.3 OUTLIER -152.02 178.73 9.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.613 179.924 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 12.0 t80 -168.73 100.94 0.4 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.966 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . 0.477 ' O ' ' O ' ' A' ' 69' ' ' LYS . 28.2 t0 -101.97 32.52 3.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.855 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.511 ' HD2' ' CE1' ' A' ' 70' ' ' TYR . 0.0 OUTLIER 39.07 -165.76 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.153 179.808 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . 0.511 ' CE1' ' HD2' ' A' ' 69' ' ' LYS . 12.4 m-85 74.56 -54.62 0.67 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.131 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -127.33 -4.25 6.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.295 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 51.69 26.13 16.22 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.361 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . 0.541 ' O ' ' CE1' ' A' ' 75' ' ' TYR . 35.7 t-20 -77.04 90.88 3.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.739 0.305 . . . . 0.0 110.965 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 56.2 m -49.52 119.41 3.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.036 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.541 ' CE1' ' O ' ' A' ' 73' ' ' ASN . 9.9 m-85 -102.95 172.8 6.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.818 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -111.92 133.55 54.04 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.781 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.448 ' HA ' ' HB3' ' A' ' 94' ' ' CYS . 53.1 t -49.4 -37.15 10.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.06 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -85.14 41.67 3.08 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.498 179.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -164.32 178.32 7.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.83 0.348 . . . . 0.0 110.993 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.465 HG23 ' CG2' ' A' ' 93' ' ' THR . 19.1 p -132.7 151.28 52.01 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.059 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.452 ' OH ' HG23 ' A' ' 102' ' ' ILE . 24.0 p90 -136.72 115.19 11.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.876 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -82.18 112.99 19.7 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.798 179.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.2 106.0 53.47 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.921 -179.924 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.45 ' HB3' HG12 ' A' ' 89' ' ' ILE . 71.5 Cg_endo -74.66 141.27 27.51 Favored 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.816 2.344 . . . . 0.0 112.303 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.462 ' O ' ' CB ' ' A' ' 86' ' ' ASP . 12.3 tptp -151.51 99.15 2.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.948 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.462 ' CB ' ' O ' ' A' ' 85' ' ' LYS . 0.3 OUTLIER 80.31 -167.54 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.907 -179.969 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.65 55.97 2.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.87 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 2.9 ptp -145.52 -60.97 0.34 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.881 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.45 HG12 ' HB3' ' A' ' 84' ' ' PRO . 60.9 mt 62.45 130.47 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.179 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . 0.614 ' N ' ' CD1' ' A' ' 90' ' ' TRP . 0.0 OUTLIER -137.65 172.76 12.48 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.884 179.971 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -110.24 82.68 1.63 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.902 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 23.2 m -68.77 135.05 50.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.981 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.465 ' CG2' HG23 ' A' ' 80' ' ' THR . 0.8 OUTLIER -115.91 174.76 5.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.924 179.782 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . 0.448 ' HB3' ' HA ' ' A' ' 77' ' ' VAL . 36.7 t -108.99 40.27 1.85 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.87 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.461 HG23 HD13 ' A' ' 95' ' ' ILE . 2.0 mt -56.76 110.68 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.38 -179.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 140.74 135.86 3.25 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.497 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -60.97 -14.77 24.98 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.838 0.352 . . . . 0.0 111.113 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . 0.422 ' O ' ' HB3' ' A' ' 99' ' ' ARG . . . -144.08 24.98 2.07 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.535 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.422 ' HB3' ' O ' ' A' ' 98' ' ' GLY . 4.5 tmm_? 64.8 132.22 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.843 0.354 . . . . 0.0 110.928 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 165.76 -36.04 0.26 Allowed Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.42 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 3.1 mtm-85 -102.52 43.12 1.09 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.832 0.348 . . . . 0.0 110.846 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . 0.452 HG23 ' OH ' ' A' ' 81' ' ' TYR . 5.2 mp -54.41 95.47 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.142 -179.821 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.72 124.66 28.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.649 179.774 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 4.1 m -129.04 121.96 28.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.994 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 1.1 t -135.83 139.88 43.79 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.985 179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.532 HG13 ' CE3' ' A' ' 90' ' ' TRP . 2.6 mt -61.1 143.05 15.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.101 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.507 ' N ' HG21 ' A' ' 106' ' ' ILE . . . 171.6 117.79 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.116 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -163.68 116.47 1.47 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.85 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 18.3 ttp180 . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.267 -0.873 . . . . 0.0 110.9 179.912 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.35 0 CA-C-O 120.835 0.35 . . . . 0.0 111.201 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.514 ' CG ' ' O ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -150.62 65.73 7.19 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.966 179.978 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -57.62 169.74 2.27 Favored 'Trans proline' 0 C--O 1.231 0.147 0 C-N-CA 122.694 2.263 . . . . 0.0 112.265 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 114.43 167.6 15.89 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.648 -0.786 . . . . 0.0 112.536 179.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 8.9 p -152.59 123.34 7.38 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.793 0.33 . . . . 0.0 110.847 -180.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 7.0 t80 -92.08 95.4 9.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.924 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.446 ' OD2' ' CE1' ' A' ' 54' ' ' PHE . 1.2 m-20 -117.0 139.61 50.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.821 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.464 ' OD1' ' O ' ' A' ' 24' ' ' ASN . 27.5 t-20 50.09 45.59 25.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.709 -179.959 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.12 16.86 28.09 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.363 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.95 152.56 47.74 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.818 0.342 . . . . 0.0 110.936 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 20.9 t-80 -116.85 97.97 6.25 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.136 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 15.6 m-85 -79.87 -178.72 6.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.854 179.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.495 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 2.1 tt0 -93.64 120.65 34.18 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.588 179.709 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.465 ' HA ' ' SG ' ' A' ' 47' ' ' CYS . 4.4 mp -33.86 138.91 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.353 -179.825 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.488 ' N ' ' O ' ' A' ' 47' ' ' CYS . 34.3 m-20 76.97 5.35 3.31 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.762 -179.686 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.495 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 11.8 tt0 -86.61 154.19 21.22 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.774 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.524 ' CG ' HG23 ' A' ' 46' ' ' THR . 36.5 mt-30 -122.64 124.84 44.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.15 -179.683 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . 0.528 ' CH2' ' O ' ' A' ' 46' ' ' THR . 22.9 p90 -131.0 175.63 8.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.791 179.742 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 33.6 tp10 -100.18 126.64 46.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.863 0.363 . . . . 0.0 111.313 -179.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.451 ' O ' ' O ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -138.25 -161.93 1.24 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.468 179.643 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 2.2 t -143.83 141.46 30.37 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.952 0.406 . . . . 0.0 111.452 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.526 ' CD2' HD12 ' A' ' 39' ' ' LEU . 9.8 t80 -131.17 132.73 44.94 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.461 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.526 HD12 ' CD2' ' A' ' 38' ' ' TYR . 3.4 mp 63.44 16.96 9.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.947 0.404 . . . . 0.0 110.319 -179.53 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 83.41 37.07 12.74 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.938 -0.649 . . . . 0.0 112.563 -179.871 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 64.1 m-80 -146.55 139.7 25.58 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 120.77 0.319 . . . . 0.0 111.075 -179.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -48.04 134.19 14.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.835 179.739 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.504 HD12 ' N ' ' A' ' 57' ' ' GLU . 0.0 OUTLIER -165.36 147.44 7.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.02 0.438 . . . . 0.0 110.954 -179.752 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.457 ' O ' ' HB3' ' A' ' 56' ' ' CYS . 5.1 t -90.11 134.46 29.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.809 179.822 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.467 ' HA ' ' HA ' ' A' ' 56' ' ' CYS . 5.4 m -119.65 123.4 43.77 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.107 -179.706 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.528 ' O ' ' CH2' ' A' ' 34' ' ' TRP . 0.2 OUTLIER -94.77 -174.04 3.17 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.003 179.868 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.528 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 27.8 t -138.69 119.8 14.55 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.85 0.357 . . . . 0.0 110.88 -179.843 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 9.9 m-30 -90.91 -46.32 8.25 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.261 -179.871 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 103.14 166.33 25.81 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.45 -179.737 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 65.31 -116.83 9.23 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.612 179.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 4.9 p -125.11 -6.85 7.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.731 0.301 . . . . 0.0 111.187 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 4.0 mtm180 -56.91 -29.28 62.91 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.897 0.379 . . . . 0.0 110.876 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 64.33 137.2 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.729 179.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.528 ' CB ' ' O ' ' A' ' 46' ' ' THR . 38.5 p90 -59.28 -167.8 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.574 0.226 . . . . 0.0 110.671 179.737 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.524 ' O ' ' CB ' ' A' ' 56' ' ' CYS . 2.3 t30 -147.16 -49.95 0.19 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.821 0.343 . . . . 0.0 111.601 -179.739 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.524 ' CB ' ' O ' ' A' ' 55' ' ' ASN . 5.2 m 85.62 -172.64 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.424 -179.611 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.504 ' N ' HD12 ' A' ' 43' ' ' LEU . 3.9 tt0 -156.78 -89.23 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.858 0.361 . . . . 0.0 111.359 -179.837 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.453 ' HA ' ' HA ' ' A' ' 43' ' ' LEU . 0.3 OUTLIER 170.97 146.44 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.835 -179.701 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -39.83 116.3 1.15 Allowed Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.813 179.941 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -60.89 -177.89 0.2 Allowed 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.702 2.268 . . . . 0.0 112.311 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -110.14 -63.37 1.39 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.976 -179.848 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.432 ' O ' ' HB1' ' A' ' 97' ' ' ALA . . . -159.15 168.32 26.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.201 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -115.46 123.19 47.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.55 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -163.86 139.4 6.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.84 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.503 ' OG1' ' CG2' ' A' ' 74' ' ' THR . 12.6 p -57.95 -176.63 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.273 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 60.1 m -114.46 156.43 24.56 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.944 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 89.8 t80 -112.35 87.6 2.61 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.972 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.95 85.96 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.937 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 4.2 ptmt -41.08 -28.2 0.08 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.869 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 14.6 m-30 -40.02 -72.74 0.06 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.924 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.421 ' HB ' ' OD1' ' A' ' 73' ' ' ASN . 6.3 m -117.78 20.79 13.25 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.099 179.817 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 55.95 54.23 36.74 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.46 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . 0.421 ' OD1' ' HB ' ' A' ' 71' ' ' THR . 0.4 OUTLIER -108.41 -162.9 0.84 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.763 0.316 . . . . 0.0 110.846 179.949 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.503 ' CG2' ' OG1' ' A' ' 65' ' ' THR . 1.1 m -146.01 133.05 20.3 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.065 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.43 ' O ' ' HB ' ' A' ' 65' ' ' THR . 2.7 m-85 -123.22 128.64 50.29 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.859 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 2.7 mmt180 -45.55 137.5 5.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.849 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.406 ' HA ' ' SG ' ' A' ' 94' ' ' CYS . 12.2 p -82.09 -17.03 11.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.194 -179.912 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -102.04 9.38 56.45 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.446 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -138.52 159.26 42.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.828 0.347 . . . . 0.0 110.896 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.497 ' OG1' ' N ' ' A' ' 81' ' ' TYR . 0.1 OUTLIER -106.59 -173.4 2.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.989 179.943 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.508 ' CZ ' ' HB3' ' A' ' 92' ' ' CYS . 15.2 p90 -164.74 -177.81 4.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.868 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -135.2 110.54 9.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.82 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.61 96.05 9.7 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.904 -179.977 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -69.78 84.37 0.66 Allowed 'Trans proline' 0 C--O 1.231 0.145 0 C-N-CA 122.78 2.32 . . . . 0.0 112.227 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.87 139.37 32.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.91 179.887 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 46.32 -157.89 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.935 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' SER . . . . . 0.442 ' O ' ' HB2' ' A' ' 88' ' ' MET . 0.4 OUTLIER -84.03 62.8 7.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.931 -179.986 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' MET . . . . . 0.442 ' HB2' ' O ' ' A' ' 87' ' ' SER . 1.3 ttt 174.44 149.6 0.08 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.926 -179.944 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.534 ' C ' ' CD1' ' A' ' 90' ' ' TRP . 17.1 mt -110.37 157.79 10.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.124 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . 0.575 ' N ' ' CD1' ' A' ' 90' ' ' TRP . 0.1 OUTLIER -146.0 134.08 21.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.948 179.989 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 29.2 t0 -72.41 62.8 0.53 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.774 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . 0.508 ' HB3' ' CZ ' ' A' ' 81' ' ' TYR . 67.9 m -55.49 146.04 21.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.052 -179.87 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.462 ' O ' ' N ' ' A' ' 95' ' ' ILE . 21.2 m -144.03 141.31 30.04 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.96 179.806 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . 0.406 ' SG ' ' HA ' ' A' ' 77' ' ' VAL . 50.3 t -66.29 60.21 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.975 -179.759 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.517 ' O ' ' N ' ' A' ' 101' ' ' ARG . 2.6 mt -68.77 80.17 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.001 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -114.34 -107.15 2.71 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.462 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.432 ' HB1' ' O ' ' A' ' 62' ' ' ALA . . . 55.09 79.79 0.14 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.748 0.309 . . . . 0.0 111.085 179.975 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 82.65 -55.28 4.99 Favored Glycine 0 N--CA 1.453 -0.207 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.448 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 6.8 mtt180 -179.12 63.23 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.889 0.376 . . . . 0.0 110.965 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . 0.461 ' O ' ' HB3' ' A' ' 101' ' ' ARG . . . -89.28 -28.21 20.73 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.528 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.517 ' N ' ' O ' ' A' ' 95' ' ' ILE . 0.0 OUTLIER 66.8 104.24 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.81 0.338 . . . . 0.0 110.9 179.952 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . 0.433 ' CG2' ' OH ' ' A' ' 81' ' ' TYR . 2.5 mp -36.32 128.36 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.126 179.81 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.502 ' HB3' ' CD1' ' A' ' 95' ' ' ILE . 29.2 t -110.21 163.08 13.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.077 -179.911 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 82.3 m -154.49 119.9 5.09 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.935 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 22.1 m -133.45 124.7 27.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.167 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.478 ' CD1' ' CZ3' ' A' ' 90' ' ' TRP . 2.4 mp -58.79 87.67 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.116 179.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -108.28 141.95 39.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.197 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -79.74 134.15 36.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.935 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.814 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 44.3 m . . . . . 0 N--CA 1.486 1.346 0 CA-C-O 120.825 0.345 . . . . 0.0 111.214 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 60.3 83.51 0.21 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.907 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -79.0 84.34 2.07 Favored 'Trans proline' 0 N--CA 1.463 -0.297 0 C-N-CA 122.853 2.369 . . . . 0.0 112.386 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 176.81 -161.66 29.63 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.515 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.576 ' O ' ' CD2' ' A' ' 27' ' ' HIS . 0.1 OUTLIER -159.15 178.38 10.08 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.779 0.323 . . . . 0.0 110.878 -179.946 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 48.2 t80 -161.89 126.67 3.38 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.945 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -163.83 159.21 20.9 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.931 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 46.19 31.96 1.34 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.914 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 65.83 21.31 69.27 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.56 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.26 152.32 44.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.831 0.348 . . . . 0.0 110.91 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . 0.576 ' CD2' ' O ' ' A' ' 21' ' ' CYS . 6.0 t-160 -117.29 96.47 5.44 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.136 -179.689 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -88.53 -162.45 0.85 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.9 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.524 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 0.5 OUTLIER -124.83 156.7 37.4 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.756 179.868 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.456 ' HA ' ' SG ' ' A' ' 47' ' ' CYS . 3.5 mp -51.99 150.46 1.04 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.37 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.125 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 17.5 m-20 64.87 13.93 8.88 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.776 -179.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.524 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 12.9 tt0 -98.54 145.53 26.71 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.792 -179.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.443 ' CG ' HG21 ' A' ' 46' ' ' THR . 14.1 mt-30 -118.01 143.69 46.19 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.848 -179.78 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . 0.577 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 35.9 p90 -144.13 -172.07 3.69 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.829 179.83 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -116.08 133.14 56.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.928 0.394 . . . . 0.0 111.239 -179.814 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.4 171.24 14.77 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.502 179.72 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -134.69 142.8 46.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.937 0.398 . . . . 0.0 110.787 -179.841 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.489 ' CB ' HD22 ' A' ' 43' ' ' LEU . 0.7 OUTLIER -155.21 120.46 4.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.686 179.671 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.475 ' CB ' ' O ' ' A' ' 38' ' ' TYR . 1.6 tp 80.91 22.62 0.36 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.58 -179.732 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 68.19 37.71 87.11 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.918 -0.658 . . . . 0.0 112.438 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.434 ' O ' ' C ' ' A' ' 42' ' ' ALA . 51.1 m-80 -148.35 133.37 18.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.667 0.27 . . . . 0.0 110.945 179.919 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.451 ' O ' HD13 ' A' ' 43' ' ' LEU . . . -35.69 153.92 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.801 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.489 HD22 ' CB ' ' A' ' 38' ' ' TYR . 3.1 tp -161.52 146.05 13.2 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.144 -179.543 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.48 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 3.9 t -121.61 136.85 57.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.417 179.547 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.577 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 0.7 OUTLIER -116.41 161.39 19.14 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.322 -179.509 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.443 HG21 ' CG ' ' A' ' 33' ' ' GLN . 1.4 m -144.29 127.73 16.93 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.936 179.818 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.499 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 19.4 t -87.28 138.61 31.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.057 -179.868 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.418 ' CE1' ' O ' ' A' ' 46' ' ' THR . 11.6 m-85 -122.4 -33.13 3.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.928 179.953 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.429 ' O ' ' HB2' ' A' ' 52' ' ' ARG . . . 64.75 -165.7 32.82 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.498 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . 0.501 ' O ' ' CB ' ' A' ' 51' ' ' SER . . . 56.65 31.13 60.19 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.523 -179.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.501 ' CB ' ' O ' ' A' ' 50' ' ' GLY . 0.8 OUTLIER 83.88 -10.01 0.95 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.706 0.289 . . . . 0.0 110.995 -179.978 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.429 ' HB2' ' O ' ' A' ' 49' ' ' GLY . 34.1 mtt85 -67.85 -46.78 70.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.021 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 92.47 -141.33 15.53 Favored Glycine 0 N--CA 1.446 -0.638 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.608 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.568 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 5.8 p90 -143.27 157.0 44.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.844 0.354 . . . . 0.0 110.92 -179.947 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 -131.57 124.89 30.97 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.809 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.48 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.5 OUTLIER -100.5 163.15 12.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.021 -179.963 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.456 ' O ' ' HA ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -175.02 -177.62 1.1 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.937 179.898 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -65.95 178.58 1.07 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.932 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.429 ' HD2' ' HD2' ' A' ' 60' ' ' PRO . 0.8 OUTLIER -78.17 157.37 78.4 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.891 179.992 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.466 ' O ' ' CB ' ' A' ' 61' ' ' GLU . 74.7 Cg_exo -49.08 -65.99 0.15 Allowed 'Trans proline' 0 N--CA 1.465 -0.169 0 C-N-CA 122.826 2.35 . . . . 0.0 112.37 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.466 ' CB ' ' O ' ' A' ' 60' ' ' PRO . 24.2 tp10 162.44 -41.46 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.815 -179.957 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -89.22 121.97 32.04 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.072 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.417 ' O ' ' HB1' ' A' ' 97' ' ' ALA . 2.7 tt0 -57.4 -15.93 7.91 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.165 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.424 ' O ' HG23 ' A' ' 65' ' ' THR . 3.1 mt-10 -64.2 120.85 12.9 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.91 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.424 HG23 ' O ' ' A' ' 64' ' ' GLU . 0.2 OUTLIER 175.59 -171.82 0.07 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.116 179.952 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.437 ' O ' HG22 ' A' ' 74' ' ' THR . 4.1 t -178.27 169.17 1.87 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.923 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 49.2 t80 -119.59 -52.95 2.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.959 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 17.6 t70 71.8 84.04 0.13 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.876 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.495 ' O ' ' CB ' ' A' ' 70' ' ' TYR . 0.0 OUTLIER -57.53 -170.61 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.903 179.914 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . 0.495 ' CB ' ' O ' ' A' ' 69' ' ' LYS . 7.3 m-85 84.4 -4.2 1.03 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.05 -179.882 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.484 ' CG2' ' C ' ' A' ' 70' ' ' TYR . 0.0 OUTLIER 165.26 -26.22 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.2 -179.95 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 97.64 76.18 1.27 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.478 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -122.09 80.16 1.67 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.749 0.309 . . . . 0.0 110.96 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.437 HG22 ' O ' ' A' ' 66' ' ' CYS . 94.4 m -50.58 110.35 0.4 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.977 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.45 ' HB2' ' SG ' ' A' ' 94' ' ' CYS . 18.1 m-85 -108.68 164.08 12.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.646 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 4.2 mtt180 -78.83 117.37 19.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.952 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.458 ' HA ' ' O ' ' A' ' 94' ' ' CYS . 7.6 p -47.83 -22.69 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.191 -179.922 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -95.06 11.54 69.29 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.517 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -144.79 151.12 38.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.814 0.34 . . . . 0.0 110.962 179.961 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.461 HG22 ' CG2' ' A' ' 93' ' ' THR . 0.6 OUTLIER -96.72 -155.41 0.48 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.14 -179.921 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.532 ' O ' ' CB ' ' A' ' 82' ' ' GLU . 9.6 p90 -172.02 -35.13 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.069 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.532 ' CB ' ' O ' ' A' ' 81' ' ' TYR . 0.7 OUTLIER 87.29 157.6 0.07 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.897 179.9 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 2.7 mtt-85 178.44 119.01 0.19 Allowed Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.849 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.73 167.62 25.17 Favored 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.748 2.299 . . . . 0.0 112.477 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.436 ' O ' ' N ' ' A' ' 87' ' ' SER . 0.0 OUTLIER -171.8 150.46 2.65 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.649 179.976 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 56.8 -85.04 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.886 -179.857 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' SER . . . . . 0.436 ' N ' ' O ' ' A' ' 85' ' ' LYS . 0.4 OUTLIER -159.71 23.18 0.18 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.952 179.848 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' MET . . . . . 0.409 ' O ' ' CD1' ' A' ' 90' ' ' TRP . 0.0 OUTLIER -148.85 146.1 27.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.971 -179.854 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 10.4 mt -90.83 134.44 29.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.986 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . 0.543 ' N ' ' CD1' ' A' ' 90' ' ' TRP . 1.0 OUTLIER -125.44 144.55 50.47 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.038 -179.901 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 57.9 m-20 -80.04 67.68 5.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.658 179.748 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 23.1 m -55.09 124.62 17.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.035 -179.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.461 ' CG2' HG22 ' A' ' 80' ' ' THR . 2.0 m -117.87 113.96 22.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.977 179.819 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . 0.458 ' O ' ' HA ' ' A' ' 77' ' ' VAL . 0.0 OUTLIER -54.41 87.62 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.878 -179.81 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.446 HG13 ' O ' ' A' ' 93' ' ' THR . 2.3 mt -117.2 95.52 3.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.196 -179.925 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.401 ' HA3' ' HA2' ' A' ' 100' ' ' GLY . . . -145.98 -94.39 0.16 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.616 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.417 ' HB1' ' O ' ' A' ' 63' ' ' GLU . . . 62.68 41.18 9.47 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.846 0.355 . . . . 0.0 111.06 -179.867 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 139.21 -27.32 2.65 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.554 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.61 -31.71 3.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.841 0.353 . . . . 0.0 110.912 -179.986 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . 0.401 ' HA2' ' HA3' ' A' ' 96' ' ' GLY . . . 60.36 50.71 64.65 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.548 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 6.0 ptp180 -99.18 54.83 0.98 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.787 0.327 . . . . 0.0 110.928 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . 0.413 ' HA ' HD13 ' A' ' 102' ' ' ILE . 5.4 mm -37.3 126.71 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.244 -179.986 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 5.9 t -99.14 131.06 45.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.888 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 24.3 m -135.4 117.45 15.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.031 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 7.3 t -130.86 161.25 32.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.123 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.471 ' CD1' ' CZ3' ' A' ' 90' ' ' TRP . 3.2 mp -82.89 121.21 35.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.091 179.911 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -49.68 140.73 10.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.149 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 65.0 t-20 -88.76 -34.85 16.97 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.869 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . 0.461 ' HG3' ' OXT' ' A' ' 109' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.947 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 5.0 m . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.809 0.337 . . . . 0.0 111.12 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.413 ' O ' ' O ' ' A' ' 19' ' ' PRO . 0.6 OUTLIER -113.77 153.9 45.89 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.116 -179.952 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.413 ' O ' ' O ' ' A' ' 18' ' ' LYS . 73.4 Cg_exo -48.46 -176.07 0.0 OUTLIER 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 122.792 2.328 . . . . 0.0 112.3 179.901 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 96.66 -156.51 21.08 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.588 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 59.7 m -147.99 97.39 2.79 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.857 0.361 . . . . 0.0 110.847 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -64.97 150.03 48.72 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.826 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.466 ' OD1' ' O ' ' A' ' 26' ' ' LYS . 4.7 p-10 -133.86 -159.99 1.01 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.14 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.421 ' C ' ' O ' ' A' ' 23' ' ' ASP . 1.5 m-20 -34.45 -42.99 0.15 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.171 -179.816 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -173.15 32.11 0.11 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.598 -0.81 . . . . 0.0 112.611 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.575 ' HB3' ' CZ ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -139.93 134.92 32.26 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.815 0.34 . . . . 0.0 110.843 179.964 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 5.8 t-160 -114.21 86.77 2.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.892 -179.67 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.575 ' CZ ' ' HB3' ' A' ' 26' ' ' LYS . 1.6 m-85 -79.62 -168.96 1.74 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.0 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -105.92 165.53 11.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.792 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.453 ' HA ' ' SG ' ' A' ' 47' ' ' CYS . 3.1 mp -58.68 150.35 5.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.473 -179.772 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 67.5 m-80 61.04 13.34 4.56 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.118 179.785 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.405 ' O ' ' CZ3' ' A' ' 34' ' ' TRP . 12.4 tt0 -91.3 150.0 21.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.679 179.813 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 11.8 mt-30 -114.41 145.02 42.37 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.137 -179.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . 0.567 ' CZ2' ' HB3' ' A' ' 45' ' ' CYS . 44.1 p90 -151.59 175.71 12.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.677 179.656 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -111.24 119.8 40.12 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.957 0.408 . . . . 0.0 111.455 -179.563 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.474 ' N ' ' O ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -110.7 -179.84 3.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.369 179.466 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.459 ' CG2' ' N ' ' A' ' 38' ' ' TYR . 1.0 OUTLIER -135.73 159.78 40.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.992 0.425 . . . . 0.0 110.975 -179.669 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.466 ' HB3' HD23 ' A' ' 43' ' ' LEU . 2.3 t80 -178.42 137.06 0.16 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.54 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 59.04 27.55 16.52 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.613 -179.746 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 67.37 49.82 48.88 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.889 -0.672 . . . . 0.0 112.666 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 68.1 m-80 -152.52 167.14 29.79 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.818 0.342 . . . . 0.0 111.016 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.431 ' O ' HD13 ' A' ' 43' ' ' LEU . . . -86.54 131.46 34.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.75 179.693 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.474 ' O ' ' N ' ' A' ' 36' ' ' ARG . 8.5 mp -127.85 155.45 44.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.319 -179.658 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.471 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 1.9 t -120.58 121.64 65.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.426 179.466 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.567 ' HB3' ' CZ2' ' A' ' 34' ' ' TRP . 1.3 m -106.99 163.29 13.1 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.281 -179.516 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.437 ' O ' ' CE1' ' A' ' 48' ' ' TYR . 2.9 m -149.25 117.52 6.44 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.832 179.782 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.453 ' SG ' ' HA ' ' A' ' 30' ' ' ILE . 21.1 t -73.97 134.49 43.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.072 -179.811 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.522 ' CB ' ' HB3' ' A' ' 52' ' ' ARG . 6.8 m-85 -107.24 -29.7 9.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.863 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.45 ' HA3' HG23 ' A' ' 30' ' ' ILE . . . 100.27 168.0 29.07 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.451 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 48.99 -123.27 10.6 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.38 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -105.15 -4.53 21.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.764 0.316 . . . . 0.0 110.998 179.961 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.522 ' HB3' ' CB ' ' A' ' 48' ' ' TYR . 2.2 mtt85 -47.9 -28.16 2.51 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.905 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 60.13 146.7 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.592 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.564 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 22.9 p90 -74.96 177.7 6.13 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.732 0.301 . . . . 0.0 110.941 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -154.85 118.67 4.6 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.958 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.471 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.8 OUTLIER -103.08 150.74 23.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.874 179.942 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.437 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 0.3 OUTLIER -136.01 -86.08 0.35 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.906 -179.958 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.416 ' HA ' ' HA ' ' A' ' 43' ' ' LEU . 5.2 p -170.01 -166.05 0.53 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.96 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.417 ' C ' ' HD2' ' A' ' 59' ' ' LYS . 0.0 OUTLIER -146.45 93.85 4.91 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.878 -179.943 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -49.85 99.58 0.04 OUTLIER 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.782 2.321 . . . . 0.0 112.259 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -40.16 -29.62 0.08 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.064 -179.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -120.59 122.49 40.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.255 -179.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -119.89 130.76 54.99 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.505 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 54.07 58.36 5.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.829 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.495 ' OG1' ' N ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -160.81 -176.44 5.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.007 -179.998 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.495 ' N ' ' OG1' ' A' ' 65' ' ' THR . 0.6 OUTLIER -171.72 175.8 3.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.924 179.913 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.465 ' CE1' ' HA ' ' A' ' 69' ' ' LYS . 20.0 t80 -165.21 110.13 0.9 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.833 -179.961 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . 0.559 ' O ' ' CD2' ' A' ' 70' ' ' TYR . 44.4 t0 -108.45 38.5 2.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.883 -179.947 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.566 ' HG3' ' CD1' ' A' ' 70' ' ' TYR . 4.3 ptmt 34.22 -154.13 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.078 179.988 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . 0.566 ' CD1' ' HG3' ' A' ' 69' ' ' LYS . 15.5 m-85 75.29 -54.22 0.65 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.949 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -138.47 -62.43 0.57 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.244 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 132.53 44.9 0.14 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.572 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -88.95 74.06 8.24 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.795 0.331 . . . . 0.0 111.011 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 33.7 m -45.87 107.88 0.11 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.927 0.394 . . . . 0.0 111.029 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 -85.47 -157.98 0.35 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.884 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . 0.428 ' O ' ' N ' ' A' ' 79' ' ' ASP . 16.2 mtm180 -143.53 135.62 26.77 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.779 179.857 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 52.9 t -43.9 -28.06 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.055 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -109.53 31.03 7.91 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.424 179.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . 0.428 ' N ' ' O ' ' A' ' 76' ' ' ARG . 0.6 OUTLIER -128.47 106.21 8.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.845 0.355 . . . . 0.0 110.829 179.998 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -85.94 118.96 25.74 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.144 -179.974 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.472 ' CZ ' ' HB3' ' A' ' 92' ' ' CYS . 30.1 p90 -120.06 173.87 6.83 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.753 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.436 ' HA ' ' O ' ' A' ' 90' ' ' TRP . 19.4 pt-20 -140.13 155.92 46.77 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.754 179.912 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.422 ' CZ ' ' HE2' ' A' ' 85' ' ' LYS . 0.0 OUTLIER -136.42 119.11 11.93 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.86 -179.929 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.66 95.09 0.62 Allowed 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.622 2.214 . . . . 0.0 112.242 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.422 ' HE2' ' CZ ' ' A' ' 83' ' ' ARG . 0.4 OUTLIER -146.81 163.76 34.99 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.905 -179.952 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 7.4 t0 56.21 49.51 15.23 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.832 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 9.3 m 43.54 31.17 0.4 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.923 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -159.18 175.56 13.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.892 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.457 ' O ' ' HA ' ' A' ' 106' ' ' ILE . 1.6 mp -126.27 134.17 67.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.158 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . 0.618 ' N ' ' CD1' ' A' ' 90' ' ' TRP . 0.0 OUTLIER -130.08 124.93 33.96 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.837 179.956 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.408 ' C ' ' O ' ' A' ' 81' ' ' TYR . 0.3 OUTLIER -78.93 71.14 5.37 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.993 -179.89 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . 0.472 ' HB3' ' CZ ' ' A' ' 81' ' ' TYR . 0.5 OUTLIER -45.97 136.42 6.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.895 179.808 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 7.2 m -115.34 122.21 45.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.164 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . 0.452 ' SG ' ' O ' ' A' ' 96' ' ' GLY . 28.5 t -67.62 69.84 0.11 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.718 179.951 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -70.3 -7.88 9.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.408 -179.753 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.459 ' HA3' ' HA3' ' A' ' 100' ' ' GLY . . . -132.15 -165.6 11.35 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.55 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.417 ' HA ' ' O ' ' A' ' 65' ' ' THR . . . -140.3 -41.29 0.42 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.919 0.39 . . . . 0.0 110.927 179.912 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -152.88 17.42 0.73 Allowed Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.322 179.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 170.8 36.97 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.784 0.325 . . . . 0.0 110.957 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . 0.459 ' HA3' ' HA3' ' A' ' 96' ' ' GLY . . . -97.8 -97.18 1.98 Allowed Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.563 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.496 ' O ' ' CG ' ' A' ' 101' ' ' ARG . 0.0 OUTLIER 170.55 75.17 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.792 0.33 . . . . 0.0 110.921 179.924 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . 0.409 HG23 ' OH ' ' A' ' 81' ' ' TYR . 18.8 mt -58.14 79.55 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.085 179.903 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.481 ' N ' ' O ' ' A' ' 101' ' ' ARG . 9.6 t -58.65 167.82 1.38 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.033 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.403 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 0.0 OUTLIER -146.8 104.95 3.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.774 179.937 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 2.8 t -118.55 135.31 54.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.117 -179.896 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.577 HD12 ' CZ3' ' A' ' 90' ' ' TRP . 2.4 mp -60.2 142.3 15.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.914 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.484 ' N ' HG23 ' A' ' 106' ' ' ILE . . . -132.95 107.31 8.21 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.052 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . 0.417 ' O ' ' C ' ' A' ' 109' ' ' ARG . 32.0 t-20 -112.13 129.81 56.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.998 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . 0.417 ' C ' ' O ' ' A' ' 108' ' ' ASN . 1.0 OUTLIER . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.155 -0.926 . . . . 0.0 110.852 179.959 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 53.9 p . . . . . 0 N--CA 1.485 1.324 0 CA-C-O 120.829 0.347 . . . . 0.0 111.096 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.21 134.78 22.76 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.948 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -76.94 170.63 19.45 Favored 'Trans proline' 0 N--CA 1.464 -0.253 0 C-N-CA 122.738 2.292 . . . . 0.0 112.418 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 126.89 171.88 13.17 Favored Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.762 -0.733 . . . . 0.0 112.512 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 50.6 m -112.19 85.66 2.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.781 0.325 . . . . 0.0 110.793 -179.981 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -74.78 124.05 26.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.0 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.425 ' O ' ' CG ' ' A' ' 24' ' ' ASN . 0.3 OUTLIER -167.91 147.6 4.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.889 179.897 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.425 ' CG ' ' O ' ' A' ' 23' ' ' ASP . 8.0 p-10 46.02 53.41 9.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.934 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 53.92 20.27 13.22 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.541 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.57 ' HB3' ' CZ ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -125.83 133.74 51.88 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.807 0.337 . . . . 0.0 111.004 -179.996 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 4.0 t-160 -117.97 84.18 2.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.956 -179.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.57 ' CZ ' ' HB3' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -79.91 167.88 19.95 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.79 179.906 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.462 ' O ' ' HB2' ' A' ' 32' ' ' GLN . 8.5 mt-30 -93.12 170.7 9.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.786 179.808 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.526 ' CG2' ' O ' ' A' ' 48' ' ' TYR . 3.0 mp -65.49 153.74 8.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.338 -179.909 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 84.6 m-20 55.01 17.69 1.97 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.089 179.8 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.462 ' HB2' ' O ' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -97.1 139.26 33.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.816 179.809 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 11.7 mt-30 -107.01 148.66 28.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.872 -179.801 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . 0.534 ' CE2' ' CE1' ' A' ' 28' ' ' TYR . 38.8 p90 -165.75 -167.41 1.1 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.902 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -119.18 125.25 48.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.067 -179.786 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.406 ' CZ ' ' OD2' ' A' ' 23' ' ' ASP . 0.4 OUTLIER -121.6 123.39 41.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.55 179.714 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.478 ' HA ' ' O ' ' A' ' 41' ' ' ASN . 1.3 m -99.89 136.27 40.05 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.828 -179.565 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 5.8 t80 -152.04 142.76 22.86 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.707 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER 53.37 41.4 32.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.674 -179.761 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 60.3 50.56 66.3 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.521 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.478 ' O ' ' HA ' ' A' ' 37' ' ' THR . 60.0 m-80 -154.37 154.11 32.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.706 0.288 . . . . 0.0 111.024 179.993 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.501 ' C ' ' CD1' ' A' ' 43' ' ' LEU . . . -100.46 111.12 23.34 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.91 179.882 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.528 ' N ' ' CD1' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -119.94 131.4 55.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.385 -179.631 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.492 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.4 t -77.83 128.61 38.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 178.762 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.561 ' SG ' ' CE1' ' A' ' 54' ' ' PHE . 1.5 m -110.1 144.19 39.07 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.014 0.435 . . . . 0.0 111.592 -179.151 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.449 ' O ' ' CD1' ' A' ' 48' ' ' TYR . 29.3 m -134.53 110.42 9.34 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.764 179.442 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.42 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 15.2 t -67.54 138.31 56.4 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.954 -179.691 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.526 ' O ' ' CG2' ' A' ' 30' ' ' ILE . 2.0 m-85 -105.38 -51.85 2.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.958 179.984 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 128.27 -179.69 16.4 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.427 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 41.15 -121.45 2.09 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.452 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -108.29 2.48 22.67 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.667 0.27 . . . . 0.0 111.093 -179.989 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.425 ' O ' ' O ' ' A' ' 53' ' ' GLY . 61.5 mtt180 -59.24 -42.09 90.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.944 179.986 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . 0.425 ' O ' ' O ' ' A' ' 52' ' ' ARG . . . 59.04 143.71 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.431 -179.921 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.561 ' CE1' ' SG ' ' A' ' 45' ' ' CYS . 1.3 p90 -58.03 150.28 21.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.943 0.401 . . . . 0.0 110.947 -179.926 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -104.46 -33.96 8.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.652 179.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.492 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.1 OUTLIER 59.27 148.29 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.051 179.864 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -130.08 -88.9 0.49 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.963 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.465 ' HA ' ' HA ' ' A' ' 43' ' ' LEU . 0.4 OUTLIER -158.0 -162.96 1.22 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.874 -179.967 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.503 ' O ' ' N ' ' A' ' 61' ' ' GLU . 0.0 OUTLIER -144.84 89.0 6.74 Favored Pre-proline 0 C--N 1.331 -0.217 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.974 -179.918 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_exo -57.56 72.23 0.04 OUTLIER 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.763 2.309 . . . . 0.0 112.214 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.503 ' N ' ' O ' ' A' ' 59' ' ' LYS . 2.0 pt-20 -70.85 -17.89 62.72 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.999 -179.933 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -82.67 112.55 19.64 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.15 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.441 ' CD ' ' CG2' ' A' ' 65' ' ' THR . 0.2 OUTLIER -62.65 -25.79 68.31 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.134 179.977 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 46.83 62.35 2.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.904 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.441 ' CG2' ' CD ' ' A' ' 63' ' ' GLU . 7.3 t -178.31 -160.11 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.189 -179.931 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.432 ' N ' HG23 ' A' ' 65' ' ' THR . 2.0 p -175.63 -178.0 1.04 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.869 -179.94 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -136.94 107.1 6.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.976 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . 0.498 ' O ' ' N ' ' A' ' 72' ' ' GLY . 12.2 t70 -78.29 67.02 4.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.745 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 10.9 ptmt -41.27 -32.16 0.27 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.026 -179.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . 0.458 ' CD1' ' N ' ' A' ' 70' ' ' TYR . 1.7 m-30 -57.17 -33.13 67.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.858 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 3.9 m -126.46 -43.24 1.76 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.175 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . 0.498 ' N ' ' O ' ' A' ' 68' ' ' ASP . . . 111.37 1.61 27.89 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.476 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -89.22 111.69 22.55 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.731 0.3 . . . . 0.0 110.892 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.423 HG22 ' O ' ' A' ' 66' ' ' CYS . 55.5 m -64.81 128.67 36.73 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.018 179.878 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.442 ' CE2' ' HB2' ' A' ' 68' ' ' ASP . 27.7 m-85 -116.19 -171.65 2.03 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.769 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 5.7 ttt180 -103.24 129.97 50.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.808 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.443 ' HA ' ' O ' ' A' ' 94' ' ' CYS . 14.0 p -49.44 -36.63 10.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.211 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -78.2 5.92 52.7 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.525 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.17 119.44 37.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.854 0.359 . . . . 0.0 110.961 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -94.83 146.91 23.88 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.165 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.468 ' CE2' ' OD1' ' A' ' 68' ' ' ASP . 3.0 p90 -146.86 121.84 10.04 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.91 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.13 148.91 25.88 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.814 179.883 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.404 ' O ' ' HG2' ' A' ' 85' ' ' LYS . 0.0 OUTLIER -152.52 118.63 3.03 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.002 179.963 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.416 ' HA ' ' HA ' ' A' ' 89' ' ' ILE . 50.5 Cg_exo -53.81 85.93 0.03 OUTLIER 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 122.706 2.271 . . . . 0.0 112.22 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.452 ' O ' ' N ' ' A' ' 87' ' ' SER . 8.4 mmtm -87.59 160.94 18.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.976 -179.839 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 49.7 m-20 45.37 -92.02 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.022 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' SER . . . . . 0.452 ' N ' ' O ' ' A' ' 85' ' ' LYS . 1.4 m -143.83 20.65 1.81 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.963 -179.935 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 10.6 ttm -152.03 173.33 15.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.795 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.45 ' O ' ' HA ' ' A' ' 106' ' ' ILE . 1.8 mt -101.22 125.95 55.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.143 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . 0.622 ' N ' ' CD1' ' A' ' 90' ' ' TRP . 0.2 OUTLIER -126.14 130.29 50.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.854 -179.937 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.46 ' N ' ' O ' ' A' ' 105' ' ' THR . 24.7 t0 -65.59 63.61 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.838 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . 0.469 ' N ' ' O ' ' A' ' 90' ' ' TRP . 8.3 m -51.13 93.38 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.991 -179.91 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.475 ' N ' ' O ' ' A' ' 103' ' ' SER . 0.2 OUTLIER -82.9 130.26 35.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.021 179.936 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . 0.443 ' O ' ' HA ' ' A' ' 77' ' ' VAL . 0.7 OUTLIER -75.91 56.89 1.0 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.997 -179.847 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.445 HG13 ' HB ' ' A' ' 93' ' ' THR . 2.0 mt -73.54 72.62 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.12 179.96 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -127.74 84.29 0.33 Allowed Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.563 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -121.99 80.71 1.73 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.852 0.358 . . . . 0.0 111.054 179.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 113.72 6.75 20.94 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.398 -179.835 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -164.86 -60.55 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.837 0.351 . . . . 0.0 110.854 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 114.45 80.19 0.91 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.475 -179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.92 102.53 7.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.791 0.329 . . . . 0.0 110.942 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . 0.494 ' N ' HD12 ' A' ' 102' ' ' ILE . 2.5 mm -85.1 76.36 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.159 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.475 ' O ' ' N ' ' A' ' 93' ' ' THR . 3.3 t -63.24 135.51 57.13 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.935 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.462 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 39.4 m -124.73 152.63 43.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.818 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' THR . . . . . 0.46 ' O ' ' N ' ' A' ' 91' ' ' ASP . 2.7 t -162.11 141.28 9.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.157 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.45 ' HA ' ' O ' ' A' ' 89' ' ' ILE . 0.8 OUTLIER -68.06 149.0 11.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.064 179.846 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -156.87 136.71 12.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.154 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -112.34 114.55 27.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.959 -179.915 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 11.0 mmt180 . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.153 -0.927 . . . . 0.0 110.899 179.856 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.5 t . . . . . 0 N--CA 1.487 1.415 0 CA-C-O 120.822 0.344 . . . . 0.0 111.15 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 41.5 mmtt -110.99 81.6 2.73 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.985 -179.888 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -79.36 124.16 5.79 Favored 'Trans proline' 0 N--CA 1.464 -0.248 0 C-N-CA 122.813 2.342 . . . . 0.0 112.436 179.972 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 119.82 168.44 13.86 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.706 179.958 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 98.0 m -118.42 109.85 16.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.806 0.336 . . . . 0.0 110.84 179.924 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 79.5 t80 -96.67 116.32 28.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.954 -179.904 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -159.22 153.51 23.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.885 -179.971 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.427 ' O ' ' CG ' ' A' ' 24' ' ' ASN . 23.7 t-20 55.89 33.65 22.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.896 179.998 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 68.42 12.8 64.29 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.555 -179.982 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.469 ' HB3' ' CE1' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -123.07 140.57 52.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.834 0.35 . . . . 0.0 110.918 179.983 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 5.6 t-160 -116.1 91.86 3.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.003 -179.826 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.582 ' CE2' ' CE2' ' A' ' 34' ' ' TRP . 0.1 OUTLIER -81.2 -179.2 7.25 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.019 179.932 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.519 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 0.0 OUTLIER -110.42 145.08 38.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.835 179.946 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.463 ' HA ' ' SG ' ' A' ' 47' ' ' CYS . 3.7 mp -41.26 148.27 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.395 -179.898 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.429 ' HB2' ' O ' ' A' ' 30' ' ' ILE . 71.5 m-80 66.63 12.92 9.09 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.136 179.801 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.519 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 56.1 tt0 -101.67 155.62 18.0 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.014 0.435 . . . . 0.0 111.23 -179.973 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.472 ' HG2' ' OG1' ' A' ' 46' ' ' THR . 23.2 mt-30 -119.34 158.83 25.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.632 179.944 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . 0.582 ' CE2' ' CE2' ' A' ' 28' ' ' TYR . 43.8 p90 -162.95 176.07 10.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.03 -179.964 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -107.11 113.69 27.3 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.087 -179.872 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.517 ' N ' ' O ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -97.48 178.18 5.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.805 179.92 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -147.39 140.58 25.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.667 -179.796 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.44 ' HB2' HD23 ' A' ' 43' ' ' LEU . 11.7 t80 -160.12 140.07 11.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.729 179.808 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 57.0 23.85 8.82 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.784 -179.879 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 75.52 32.86 53.95 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.888 -0.673 . . . . 0.0 112.747 179.819 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.461 ' O ' HD11 ' A' ' 43' ' ' LEU . 91.0 m-20 -136.38 148.36 47.79 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 120.875 0.369 . . . . 0.0 110.984 179.796 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -71.65 133.82 45.94 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.767 179.841 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.517 ' O ' ' N ' ' A' ' 36' ' ' ARG . 10.0 mp -126.44 153.34 45.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.358 -179.649 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.47 ' O ' ' HB3' ' A' ' 56' ' ' CYS . 2.2 t -113.02 124.14 69.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.026 -0.534 . . . . 0.0 109.904 179.033 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.569 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 9.4 m -113.28 161.71 16.89 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.902 -178.838 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.484 ' O ' ' CE1' ' A' ' 48' ' ' TYR . 55.2 m -151.63 109.87 3.74 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.664 179.638 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.534 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 16.9 t -66.83 145.22 55.72 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.971 -179.765 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.484 ' CE1' ' O ' ' A' ' 46' ' ' THR . 4.0 m-85 -115.47 -42.51 3.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.852 -179.956 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 149.32 41.16 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.422 -179.901 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 49.42 47.49 35.6 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.487 -179.958 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 71.1 p -156.04 -58.9 0.1 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.841 0.353 . . . . 0.0 110.785 -179.977 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 13.7 mtp180 -75.96 1.17 16.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.078 179.984 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 62.35 116.89 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.743 -0.742 . . . . 0.0 112.519 179.948 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.567 ' CG ' ' O ' ' A' ' 54' ' ' PHE . 15.1 p90 -56.47 99.03 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.832 0.348 . . . . 0.0 110.836 179.976 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -72.45 140.56 48.36 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.955 -179.919 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.496 ' SG ' ' CD2' ' A' ' 54' ' ' PHE . 2.3 m -145.99 175.18 10.64 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.933 -179.916 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -171.03 -174.17 1.46 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.918 -179.95 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.414 ' O ' ' C ' ' A' ' 59' ' ' LYS . 5.0 p -79.77 136.24 36.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.876 179.993 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.414 ' C ' ' O ' ' A' ' 58' ' ' SER . 0.0 OUTLIER -36.69 107.85 0.38 Allowed Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.902 -179.927 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -48.68 -176.64 0.0 OUTLIER 'Trans proline' 0 N--CA 1.465 -0.165 0 C-N-CA 122.823 2.349 . . . . 0.0 112.262 179.876 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -133.06 6.3 3.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.137 179.978 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -46.85 97.93 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.898 0.38 . . . . 0.0 111.024 179.933 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -104.84 -20.52 13.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.697 -179.882 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.426 ' OE2' ' NE ' ' A' ' 76' ' ' ARG . 3.0 tt0 -73.62 88.09 1.68 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.887 -179.888 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.496 ' OG1' ' N ' ' A' ' 66' ' ' CYS . 0.5 OUTLIER -168.58 176.63 5.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.079 179.918 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.496 ' N ' ' OG1' ' A' ' 65' ' ' THR . 0.1 OUTLIER 177.53 -66.07 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.923 -179.949 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.438 ' O ' ' N ' ' A' ' 69' ' ' LYS . 46.2 t80 63.28 74.82 0.41 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.951 179.935 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . 0.514 ' O ' ' N ' ' A' ' 72' ' ' GLY . 15.0 t70 -41.27 95.19 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.85 179.982 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.438 ' N ' ' O ' ' A' ' 67' ' ' PHE . 2.2 pttm -57.11 -17.41 10.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.916 -179.926 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -65.84 -56.27 12.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.102 -179.866 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.99 7.04 14.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.277 -179.904 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . 0.514 ' N ' ' O ' ' A' ' 68' ' ' ASP . . . 59.77 31.62 72.15 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.382 179.947 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -84.05 -172.96 4.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.852 0.358 . . . . 0.0 110.773 179.93 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 15.8 m -111.03 79.06 1.16 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.968 179.925 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.459 ' CD2' ' HB2' ' A' ' 68' ' ' ASP . 11.1 m-30 -89.46 169.56 11.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.893 -179.99 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . 0.426 ' NE ' ' OE2' ' A' ' 64' ' ' GLU . 0.0 OUTLIER -128.01 135.97 50.63 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.766 -179.966 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.449 ' HA ' ' O ' ' A' ' 94' ' ' CYS . 2.3 p -48.53 -26.53 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.945 -179.965 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -90.1 8.25 80.14 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.513 -179.955 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -125.43 127.51 46.64 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.849 0.357 . . . . 0.0 110.787 179.966 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 5.0 t -103.35 150.8 23.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.148 -179.874 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.498 ' O ' ' CG ' ' A' ' 81' ' ' TYR . 25.9 p90 -140.84 112.09 7.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.824 179.844 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.486 ' CB ' ' OD1' ' A' ' 91' ' ' ASP . 6.1 pt-20 -86.12 136.12 33.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.974 -179.835 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.42 ' HA ' ' HD2' ' A' ' 84' ' ' PRO . 4.4 mtt180 -110.59 106.79 58.04 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.815 -179.991 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.454 ' HA ' HG12 ' A' ' 89' ' ' ILE . 34.0 Cg_endo -64.62 88.35 0.17 Allowed 'Trans proline' 0 C--O 1.231 0.156 0 C-N-CA 122.784 2.323 . . . . 0.0 112.283 179.983 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 2.4 mttm -126.74 126.32 43.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.934 179.995 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.491 ' CB ' ' SD ' ' A' ' 88' ' ' MET . 0.4 OUTLIER 67.92 177.42 0.25 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.841 179.905 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.2 m -84.99 55.58 3.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.945 -179.987 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 88' ' ' MET . . . . . 0.491 ' SD ' ' CB ' ' A' ' 86' ' ' ASP . 0.0 OUTLIER -150.23 -47.41 0.13 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.83 -179.947 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.484 ' C ' ' CD1' ' A' ' 90' ' ' TRP . 35.6 mt 62.76 137.4 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.839 179.97 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . 0.604 ' N ' ' CD1' ' A' ' 90' ' ' TRP . 0.1 OUTLIER -142.67 124.55 15.16 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.934 -179.881 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.486 ' OD1' ' CB ' ' A' ' 82' ' ' GLU . 93.8 m-20 -75.21 72.89 2.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.939 179.983 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . 0.464 ' HA ' ' O ' ' A' ' 103' ' ' SER . 0.1 OUTLIER -52.34 99.19 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.956 179.879 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 2.5 m -80.88 127.92 33.09 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.008 179.903 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . 0.458 ' HA ' HD12 ' A' ' 102' ' ' ILE . 1.8 t -70.49 72.55 0.5 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.989 -179.856 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 1.9 mt -67.99 149.12 11.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.162 179.97 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -159.92 -102.82 0.18 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.644 -179.947 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . 48.69 37.78 10.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.836 0.351 . . . . 0.0 111.019 -179.914 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 120.43 -38.42 2.74 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.506 179.999 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.22 99.78 6.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.769 0.318 . . . . 0.0 110.882 -179.926 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -69.96 77.62 0.41 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.433 179.93 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -120.8 93.73 4.12 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.805 0.336 . . . . 0.0 110.961 -179.983 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . 0.458 HD12 ' HA ' ' A' ' 94' ' ' CYS . 6.6 mm -60.75 123.91 14.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.124 179.906 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.464 ' O ' ' HA ' ' A' ' 92' ' ' CYS . 25.3 t -105.93 125.81 51.44 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.991 -179.92 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.441 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 0.5 OUTLIER -102.27 86.5 2.84 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.962 -179.924 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 4.7 t -73.12 131.75 42.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.113 179.918 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.563 ' HB ' ' CZ3' ' A' ' 90' ' ' TRP . 0.9 OUTLIER -62.87 148.78 10.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.959 179.794 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.432 ' HB2' ' O ' ' A' ' 89' ' ' ILE . . . -77.6 168.52 19.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.019 179.941 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -175.54 145.1 0.71 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.891 -179.961 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 4.1 mtt180 . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.855 -179.98 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.503 ' OG ' ' N ' ' A' ' 18' ' ' LYS . 14.1 t . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.837 0.351 . . . . 0.0 111.095 . . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.503 ' N ' ' OG ' ' A' ' 17' ' ' SER . 44.0 tttt -155.35 129.75 4.86 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.983 179.952 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 18' ' ' LYS . 39.6 Cg_exo -57.1 -165.33 0.02 OUTLIER 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.888 2.392 . . . . 0.0 112.256 179.943 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.471 ' HA2' HD13 ' A' ' 30' ' ' ILE . . . 82.33 122.87 0.72 Allowed Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.572 179.947 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.468 ' O ' ' HB2' ' A' ' 22' ' ' TYR . 11.7 m -79.49 -179.91 7.09 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.83 0.347 . . . . 0.0 110.752 179.781 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.468 ' HB2' ' O ' ' A' ' 21' ' ' CYS . 85.7 t80 174.93 119.35 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.919 179.942 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -153.95 156.89 38.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.856 -179.996 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.4 ' CG ' ' O ' ' A' ' 24' ' ' ASN . 29.3 t-20 48.35 27.47 1.37 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.88 -179.943 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.06 -3.55 70.56 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.523 179.965 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.57 ' HB3' ' CZ ' ' A' ' 28' ' ' TYR . 0.9 OUTLIER -91.95 135.52 33.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.837 0.351 . . . . 0.0 110.852 -179.986 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 3.9 t-160 -113.47 90.82 3.44 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.997 -179.984 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.57 ' CZ ' ' HB3' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -84.98 142.61 29.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.988 179.938 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.526 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 6.7 mt-30 -76.39 147.0 38.32 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.587 179.771 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.529 ' CD1' ' SG ' ' A' ' 47' ' ' CYS . 7.6 mm -49.5 147.59 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.961 0.41 . . . . 0.0 110.982 179.979 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.423 ' CG ' HG21 ' A' ' 30' ' ' ILE . 61.3 m-20 67.1 7.77 5.67 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.042 179.956 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.526 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 1.5 tt0 -92.76 151.79 19.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.849 0.356 . . . . 0.0 110.9 179.932 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -124.8 136.54 53.92 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.043 -179.826 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . 0.573 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 19.3 p90 -134.86 -170.96 2.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.759 179.876 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.459 ' HG3' HG22 ' A' ' 44' ' ' VAL . 2.2 mt-10 -130.76 125.17 33.12 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.922 0.391 . . . . 0.0 111.159 -179.868 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.466 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 0.1 OUTLIER -122.85 172.89 8.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.74 179.742 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -126.37 143.94 51.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.757 -179.769 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.507 ' CB ' HD22 ' A' ' 43' ' ' LEU . 1.7 t80 -155.92 125.45 6.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.611 179.769 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 74.36 14.61 3.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.522 -179.879 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 80.01 45.49 8.27 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.611 -179.957 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 7.5 m-80 -149.46 168.33 23.74 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 120.789 0.328 . . . . 0.0 110.995 179.865 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -82.82 132.08 35.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.953 179.805 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.507 HD22 ' CB ' ' A' ' 38' ' ' TYR . 10.3 mp -136.52 146.28 46.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.972 0.415 . . . . 0.0 111.311 -179.718 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.478 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.4 t -114.74 130.6 68.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.139 179.05 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.573 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 1.3 m -112.06 166.54 11.15 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.096 0.474 . . . . 0.0 111.537 -179.323 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.457 ' O ' ' HA ' ' A' ' 54' ' ' PHE . 27.9 m -143.52 147.56 34.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.663 -0.698 . . . . 0.0 110.69 179.704 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.568 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 21.9 t -106.88 143.91 34.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.937 -179.825 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.44 ' N ' ' CD1' ' A' ' 48' ' ' TYR . 3.1 m-85 -130.37 -47.08 1.08 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.919 179.906 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.506 ' CA ' HD12 ' A' ' 30' ' ' ILE . . . 99.91 -50.22 1.12 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.793 -0.718 . . . . 0.0 112.428 -179.921 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -70.46 -152.88 0.91 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.486 179.913 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.12 -6.14 45.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.7 0.286 . . . . 0.0 111.016 179.986 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 1.3 mtt180 -62.68 -38.25 89.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.106 -179.932 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 61.42 155.82 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.657 -0.782 . . . . 0.0 112.303 -179.887 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.558 ' CE1' ' SG ' ' A' ' 45' ' ' CYS . 0.2 OUTLIER -72.88 126.59 30.29 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.794 0.33 . . . . 0.0 110.818 -179.966 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 43.9 m-80 -120.47 118.27 29.84 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.767 179.97 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.478 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.1 OUTLIER -89.28 167.27 13.2 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.061 -179.837 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -151.24 151.04 31.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.836 179.938 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.462 ' O ' ' O ' ' A' ' 59' ' ' LYS . 4.9 p -72.19 77.94 0.97 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.968 -179.933 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.462 ' O ' ' O ' ' A' ' 58' ' ' SER . 12.3 tptt 38.69 97.08 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.048 179.883 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -69.24 -167.31 0.2 Allowed 'Trans proline' 0 N--CA 1.465 -0.164 0 C-N-CA 122.825 2.35 . . . . 0.0 112.275 179.882 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -134.55 24.89 3.75 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.947 179.91 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -52.71 145.24 12.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.073 179.959 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -90.1 122.53 33.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.481 179.944 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.411 ' HB3' HG11 ' A' ' 77' ' ' VAL . 1.8 mp0 -151.53 122.31 7.52 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.964 -179.866 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.463 ' O ' ' HA3' ' A' ' 96' ' ' GLY . 0.0 OUTLIER -173.91 -172.01 0.69 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.0 179.96 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 1.7 p -171.5 171.47 5.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.961 179.959 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -160.6 106.74 1.49 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.027 179.998 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 50.2 t0 -70.44 88.05 0.65 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.825 179.965 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.426 ' O ' ' C ' ' A' ' 70' ' ' TYR . 0.5 OUTLIER -59.35 -37.44 77.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.997 -179.975 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . 0.426 ' C ' ' O ' ' A' ' 69' ' ' LYS . 10.5 m-30 -36.13 -40.57 0.22 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.863 179.949 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 91.2 m -121.58 -30.45 4.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.138 179.88 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 107.18 14.14 19.39 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.37 -179.924 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 15.4 m-20 -92.73 176.81 6.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.923 0.392 . . . . 0.0 110.967 179.981 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.405 HG23 ' N ' ' A' ' 75' ' ' TYR . 90.0 m -132.85 136.41 46.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.959 179.88 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.459 ' CD2' ' CE2' ' A' ' 81' ' ' TYR . 34.7 m-85 -128.38 -170.72 2.3 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.74 -179.972 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 31.1 mtt-85 -99.18 124.52 44.3 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.808 179.921 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.411 HG11 ' HB3' ' A' ' 64' ' ' GLU . 7.3 p -54.0 -27.27 15.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.169 -179.93 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -79.83 -4.99 89.63 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.578 -179.979 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -123.17 -174.52 2.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.833 0.349 . . . . 0.0 110.98 -179.989 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 13.6 t -144.63 -174.68 4.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.979 -179.98 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.459 ' CE2' ' CD2' ' A' ' 75' ' ' TYR . 33.3 p90 -159.92 153.85 23.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.952 179.963 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 54.4 tt0 -82.88 140.77 32.69 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.875 179.98 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.43 110.43 9.7 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.971 -179.883 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -74.32 98.36 1.1 Allowed 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 122.736 2.291 . . . . 0.0 112.381 179.977 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.402 ' O ' ' CB ' ' A' ' 86' ' ' ASP . 0.1 OUTLIER -131.55 123.26 27.59 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.91 -179.993 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.402 ' CB ' ' O ' ' A' ' 85' ' ' LYS . 2.6 t0 77.31 -155.18 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.924 179.954 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 59.3 p -85.26 -3.24 58.75 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.125 179.925 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 2.7 tpt -128.09 163.91 23.58 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.889 -179.949 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.514 ' C ' ' CD1' ' A' ' 90' ' ' TRP . 2.3 mp -106.23 152.45 7.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.052 179.88 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . 0.618 ' N ' ' CD1' ' A' ' 90' ' ' TRP . 0.1 OUTLIER -143.81 141.81 30.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.963 -179.986 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -91.34 70.85 6.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.924 179.963 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . 0.419 ' HA ' ' HA ' ' A' ' 104' ' ' CYS . 72.1 m -47.9 99.95 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.039 -179.958 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.26 122.29 19.97 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.879 179.896 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -63.76 86.47 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.938 -179.84 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.463 HG22 ' O ' ' A' ' 100' ' ' GLY . 1.1 mt -100.0 102.11 13.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.147 -179.948 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.467 ' O ' ' HA3' ' A' ' 100' ' ' GLY . . . -112.08 -136.53 6.86 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.706 -179.969 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.448 ' CB ' ' O ' ' A' ' 96' ' ' GLY . . . 79.76 -157.46 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.632 0.253 . . . . 0.0 110.875 -179.776 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -42.36 -30.83 0.87 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.515 -0.85 . . . . 0.0 112.204 179.871 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.51 ' O ' ' N ' ' A' ' 101' ' ' ARG . 3.9 ttp180 -155.69 -55.03 0.09 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.846 0.355 . . . . 0.0 110.377 179.824 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . 0.467 ' HA3' ' O ' ' A' ' 96' ' ' GLY . . . 58.14 -75.22 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.952 -0.642 . . . . 0.0 112.779 179.667 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.521 ' O ' ' CD ' ' A' ' 101' ' ' ARG . 0.0 OUTLIER 69.11 87.07 0.12 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.831 0.348 . . . . 0.0 110.494 -179.733 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 3.7 mp -41.2 122.13 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.18 179.96 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.491 ' HB2' ' NH2' ' A' ' 101' ' ' ARG . 19.5 t -105.38 133.01 50.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.929 -179.913 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.419 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 38.3 m -112.32 132.1 55.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.883 179.902 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 105' ' ' THR . . . . . 0.407 ' O ' ' HA ' ' A' ' 90' ' ' TRP . 5.0 t -140.72 143.67 35.14 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.216 -179.931 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.463 ' HA ' ' O ' ' A' ' 89' ' ' ILE . 5.8 mt -47.91 155.24 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.902 179.919 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.449 ' N ' HG23 ' A' ' 106' ' ' ILE . . . -90.59 111.95 23.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.059 -179.99 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -92.65 154.52 18.32 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.863 -179.941 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 15.1 ptt85 . . . . . 0 C--O 1.248 0.985 0 CA-C-O 118.273 -0.87 . . . . 0.0 110.875 -179.919 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.414 ' O ' ' C ' ' A' ' 18' ' ' LYS . 3.5 t . . . . . 0 N--CA 1.486 1.334 0 CA-C-O 120.836 0.35 . . . . 0.0 111.284 . . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 0.414 ' C ' ' O ' ' A' ' 17' ' ' SER . 0.0 OUTLIER 36.82 67.65 1.7 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.958 179.956 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -57.74 157.42 23.74 Favored 'Trans proline' 0 C--N 1.341 0.136 0 C-N-CA 122.771 2.314 . . . . 0.0 112.178 179.997 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 152.18 -162.06 29.64 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.514 -179.976 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 17.1 m -152.67 97.92 2.29 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.916 0.388 . . . . 0.0 110.819 179.979 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -71.83 135.21 46.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.982 -179.986 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . 0.41 ' HB3' ' ND2' ' A' ' 24' ' ' ASN . 0.2 OUTLIER -157.48 121.98 4.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.95 179.995 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.41 ' ND2' ' HB3' ' A' ' 23' ' ' ASP . 3.1 p30 44.62 47.42 8.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.048 179.934 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 71.11 2.17 45.79 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.638 179.924 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.405 ' N ' ' O ' ' A' ' 23' ' ' ASP . 0.0 OUTLIER -103.26 133.33 48.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.834 0.349 . . . . 0.0 110.906 179.961 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -116.73 91.94 3.73 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.963 -179.769 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.598 ' CE2' ' CE2' ' A' ' 34' ' ' TRP . 3.2 m-85 -79.79 130.52 35.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.946 -179.955 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.48 ' O ' ' HB2' ' A' ' 32' ' ' GLN . 3.2 tt0 -63.25 135.05 56.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.599 179.891 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.504 ' CG1' ' HA2' ' A' ' 49' ' ' GLY . 4.2 mp -31.85 139.07 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.512 -179.924 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . 0.484 ' HB2' ' O ' ' A' ' 30' ' ' ILE . 61.0 m-20 78.11 0.74 2.72 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.124 -179.78 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.48 ' HB2' ' O ' ' A' ' 29' ' ' GLN . 6.3 mm100 -76.94 141.71 40.36 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.819 0.342 . . . . 0.0 110.885 179.81 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . 0.41 ' HG2' HG21 ' A' ' 46' ' ' THR . 11.4 mt-30 -114.13 132.33 56.1 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.037 -179.962 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . 0.598 ' CE2' ' CE2' ' A' ' 28' ' ' TYR . 42.6 p90 -148.61 -168.46 3.1 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.921 -179.935 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.449 ' HG3' HG23 ' A' ' 44' ' ' VAL . 0.0 OUTLIER -122.44 132.78 54.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.967 -179.799 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.532 ' O ' ' CD2' ' A' ' 43' ' ' LEU . 0.4 OUTLIER -119.95 167.56 12.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.773 179.879 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -109.43 164.23 12.69 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.086 -179.86 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . 0.435 ' HB2' HD23 ' A' ' 43' ' ' LEU . 0.1 OUTLIER -156.14 93.01 1.39 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.651 179.91 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.405 ' HB2' ' O ' ' A' ' 38' ' ' TYR . 0.8 OUTLIER 67.2 18.59 10.36 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.694 -179.707 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 107.11 8.97 30.67 Favored Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.62 179.996 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 50.1 m-80 -94.78 -173.11 2.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.852 0.358 . . . . 0.0 111.018 -179.908 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.442 ' C ' ' CD1' ' A' ' 43' ' ' LEU . . . -135.48 107.83 7.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.924 179.844 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.585 ' N ' ' CD1' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -121.89 157.59 30.85 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.156 -179.889 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.468 ' O ' ' HB3' ' A' ' 56' ' ' CYS . 2.8 t -95.8 132.09 40.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.176 -0.466 . . . . 0.0 109.934 179.122 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.52 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 1.8 m -114.29 157.17 23.12 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.738 -179.092 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.45 ' HA ' ' O ' ' A' ' 32' ' ' GLN . 4.6 m -146.18 130.81 17.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.599 179.545 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.488 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 20.0 t -83.79 139.16 32.87 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.029 -179.644 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.472 ' CD1' ' O ' ' A' ' 53' ' ' GLY . 5.5 m-85 -119.56 -14.93 9.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.967 -179.925 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.504 ' HA2' ' CG1' ' A' ' 30' ' ' ILE . . . 132.09 -165.22 23.6 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.557 179.94 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . 0.514 ' O ' ' CB ' ' A' ' 51' ' ' SER . . . -91.98 67.09 2.12 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.534 -179.977 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.514 ' CB ' ' O ' ' A' ' 50' ' ' GLY . 0.1 OUTLIER 159.66 -51.73 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.756 0.312 . . . . 0.0 110.908 179.99 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 9.5 mtt-85 -57.27 -19.08 19.54 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.904 179.925 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . 0.472 ' O ' ' CD1' ' A' ' 48' ' ' TYR . . . 73.54 172.46 24.76 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.597 179.832 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.577 ' CG ' ' O ' ' A' ' 54' ' ' PHE . 11.3 p90 -114.23 96.59 5.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.828 0.346 . . . . 0.0 110.838 179.989 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 61.0 m-20 -71.14 138.31 49.54 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.708 179.991 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.506 ' SG ' ' CD2' ' A' ' 54' ' ' PHE . 3.0 m -144.2 162.11 37.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.942 0.401 . . . . 0.0 111.231 -179.648 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.458 ' O ' ' O ' ' A' ' 58' ' ' SER . 0.5 OUTLIER -162.72 160.9 26.03 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.771 179.857 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.458 ' O ' ' O ' ' A' ' 57' ' ' GLU . 0.6 OUTLIER -37.3 161.01 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.945 179.993 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -103.2 107.57 55.97 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.034 -179.932 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -76.56 124.52 7.69 Favored 'Trans proline' 0 N--CA 1.464 -0.228 0 C-N-CA 122.82 2.347 . . . . 0.0 112.416 -179.994 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -111.09 -23.82 10.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.703 179.858 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -131.52 125.45 32.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.004 179.886 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -91.01 -27.09 18.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.609 -179.972 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.46 ' HG3' ' HB ' ' A' ' 77' ' ' VAL . 5.8 tt0 66.26 114.37 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.921 179.86 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.438 ' CG2' ' O ' ' A' ' 64' ' ' GLU . 0.2 OUTLIER 171.82 169.33 0.1 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.195 179.985 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.423 ' HB2' ' C ' ' A' ' 75' ' ' TYR . 0.8 OUTLIER -153.05 -175.09 5.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.783 179.98 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -129.78 -37.22 1.55 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.943 -179.928 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . 0.445 ' O ' ' O ' ' A' ' 69' ' ' LYS . 27.3 t0 59.98 63.99 1.35 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.806 179.997 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.445 ' O ' ' O ' ' A' ' 68' ' ' ASP . 9.7 ptmt -45.44 176.07 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.882 179.98 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . 0.552 ' CE2' ' HE2' ' A' ' 85' ' ' LYS . 20.4 m-85 65.37 17.78 11.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.955 -179.997 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.471 ' CG2' ' O ' ' A' ' 70' ' ' TYR . 0.7 OUTLIER -177.75 -34.47 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.218 -179.994 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 80.04 42.62 10.64 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.553 -179.991 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . 0.409 ' O ' ' CB ' ' A' ' 68' ' ' ASP . 0.1 OUTLIER -100.58 116.12 31.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.791 0.329 . . . . 0.0 110.855 179.97 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.43 ' O ' ' NH2' ' A' ' 76' ' ' ARG . 5.2 m -70.61 100.47 1.84 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.101 179.957 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.423 ' C ' ' HB2' ' A' ' 66' ' ' CYS . 3.9 m-30 -92.29 -174.49 3.74 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.853 -179.953 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . 0.43 ' NH2' ' O ' ' A' ' 74' ' ' THR . 0.6 OUTLIER -129.69 157.71 41.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.808 179.938 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.46 ' HB ' ' HG3' ' A' ' 64' ' ' GLU . 75.7 t -63.67 -20.57 26.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.136 179.941 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -91.18 31.0 5.91 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.461 179.933 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -148.9 148.44 29.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.882 0.372 . . . . 0.0 111.114 179.971 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.445 HG22 HG21 ' A' ' 93' ' ' THR . 80.6 p -125.39 169.61 12.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.026 179.974 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.409 ' O ' ' O ' ' A' ' 92' ' ' CYS . 11.0 p90 -174.29 134.92 0.43 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.936 179.96 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 11.6 mp0 -87.82 165.39 15.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.968 -179.996 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . 0.496 ' NE ' ' HD2' ' A' ' 84' ' ' PRO . 0.0 OUTLIER -148.3 113.13 3.8 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.772 179.966 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.496 ' HD2' ' NE ' ' A' ' 83' ' ' ARG . 37.4 Cg_endo -66.2 74.1 0.36 Allowed 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.699 2.266 . . . . 0.0 112.254 179.986 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.552 ' HE2' ' CE2' ' A' ' 70' ' ' TYR . 4.9 mmtt -100.08 131.06 46.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.871 -179.959 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 9.5 t0 57.23 -173.85 0.08 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.778 179.962 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 87' ' ' SER . . . . . 0.46 ' O ' ' HB2' ' A' ' 88' ' ' MET . 8.5 m -72.48 58.58 0.41 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.958 179.967 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 88' ' ' MET . . . . . 0.46 ' HB2' ' O ' ' A' ' 87' ' ' SER . 1.9 ttm 176.48 166.93 0.47 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.859 -179.999 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 1.9 mp -123.84 146.18 29.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.108 179.989 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . 0.623 ' N ' ' CD1' ' A' ' 90' ' ' TRP . 0.0 OUTLIER -137.09 139.17 41.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.811 -179.941 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -77.91 63.36 2.91 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.757 179.889 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . 0.435 ' HA ' ' O ' ' A' ' 103' ' ' SER . 3.8 m -44.88 112.52 0.44 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.163 -179.895 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.512 ' N ' ' O ' ' A' ' 103' ' ' SER . 0.9 OUTLIER -96.48 143.49 27.45 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.78 179.771 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . 0.424 ' SG ' ' O ' ' A' ' 76' ' ' ARG . 3.5 t -74.58 81.44 1.99 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.047 -179.822 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.502 ' CG1' ' HB2' ' A' ' 103' ' ' SER . 2.6 mt -101.51 145.11 12.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.209 179.987 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 116.05 146.43 8.67 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.499 -179.914 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -89.27 45.32 1.28 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.806 0.336 . . . . 0.0 111.154 -179.91 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 142.05 -9.45 2.5 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.649 179.849 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.518 ' O ' ' N ' ' A' ' 101' ' ' ARG . 0.9 OUTLIER 173.6 -40.84 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.782 0.325 . . . . 0.0 110.936 -179.983 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . 0.404 ' C ' ' O ' ' A' ' 99' ' ' ARG . . . 38.16 -91.5 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.384 -179.958 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.518 ' N ' ' O ' ' A' ' 99' ' ' ARG . 0.0 OUTLIER -179.03 33.68 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.748 0.309 . . . . 0.0 110.982 179.758 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . 0.451 ' C ' ' O ' ' A' ' 101' ' ' ARG . 3.2 mt 28.55 89.26 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.671 179.756 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.512 ' O ' ' N ' ' A' ' 93' ' ' THR . 1.4 t -55.78 148.49 16.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.868 179.941 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . 0.447 ' SG ' ' O ' ' A' ' 103' ' ' SER . 18.5 m -157.17 142.82 17.52 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.973 -179.939 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -162.18 134.61 5.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.069 179.996 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.571 HG13 ' CE3' ' A' ' 90' ' ' TRP . 3.5 mt -51.15 142.12 3.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.086 179.887 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -63.0 170.22 2.87 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.126 179.929 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -96.87 95.19 7.69 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.945 179.999 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.247 -0.883 . . . . 0.0 110.924 179.969 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 50.3 m . . . . . 0 N--CA 1.487 1.384 0 CA-C-O 120.8 0.333 . . . . 0.0 111.081 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.7 pttp -176.24 96.35 0.25 Allowed Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.987 -179.885 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -80.04 167.54 19.87 Favored 'Trans proline' 0 N--CA 1.464 -0.237 0 C-N-CA 122.841 2.361 . . . . 0.0 112.522 -179.886 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' GLY . . . . . 0.487 ' HA2' ' CD1' ' A' ' 30' ' ' ILE . . . 79.51 159.8 17.93 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.623 179.791 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.479 ' O ' ' CD2' ' A' ' 27' ' ' HIS . 1.6 m -92.03 174.3 7.39 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.743 0.306 . . . . 0.0 110.921 179.936 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 85.3 t80 177.61 143.98 0.1 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.864 -179.976 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 166.66 169.7 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.87 179.977 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.418 ' O ' ' CG ' ' A' ' 24' ' ' ASN . 35.1 t30 54.09 24.34 4.73 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.902 179.927 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 77.4 6.73 86.76 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.576 179.94 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.577 ' HB3' ' CE1' ' A' ' 28' ' ' TYR . 2.1 ttpt -119.74 149.48 41.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.75 0.309 . . . . 0.0 110.876 -179.985 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . 0.479 ' CD2' ' O ' ' A' ' 21' ' ' CYS . 3.0 t-160 -116.51 96.42 5.51 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.109 -179.834 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.577 ' CE1' ' HB3' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -90.73 171.53 9.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.96 -179.995 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.466 ' O ' ' HB2' ' A' ' 32' ' ' GLN . 0.1 OUTLIER -95.17 173.88 7.34 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.905 179.934 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.487 ' CD1' ' HA2' ' A' ' 20' ' ' GLY . 33.5 mm -72.45 148.41 9.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.166 -179.989 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 65.6 m-20 64.24 10.73 5.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.852 -179.918 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.466 ' HB2' ' O ' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -88.78 158.31 18.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.784 -179.999 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -119.29 138.59 52.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.956 -179.87 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . 0.536 ' CE2' ' HB2' ' A' ' 45' ' ' CYS . 37.2 p90 -149.59 -179.77 7.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.037 -179.904 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.47 ' HG2' ' O ' ' A' ' 43' ' ' LEU . 3.9 tt0 -117.58 128.82 55.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.577 -179.991 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 36' ' ' ARG . . . . . 0.527 ' O ' ' CD2' ' A' ' 43' ' ' LEU . 2.9 ttt180 -114.82 169.79 8.82 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.811 0.338 . . . . 0.0 110.965 -179.985 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.1 m -130.05 130.48 44.97 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.644 -179.916 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -147.74 143.78 27.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.791 179.85 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 51.24 35.28 13.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.681 -179.838 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 66.95 38.8 93.07 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.827 -0.701 . . . . 0.0 112.494 -179.89 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 36.3 m-20 -134.87 179.77 6.1 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 120.856 0.36 . . . . 0.0 110.934 -179.93 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -125.67 118.75 26.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.988 179.859 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.585 ' N ' ' CD1' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -124.9 163.67 21.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.961 0.41 . . . . 0.0 111.347 -179.871 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.462 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.4 t -111.97 125.06 69.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.092 179.163 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.536 ' HB2' ' CE2' ' A' ' 34' ' ' TRP . 89.0 m -103.66 163.75 12.11 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.789 -178.874 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.441 ' O ' ' HA ' ' A' ' 54' ' ' PHE . 21.1 m -146.13 119.28 8.85 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.601 179.708 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.52 ' HB2' ' CH2' ' A' ' 34' ' ' TRP . 13.4 t -79.06 154.94 29.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.128 -179.61 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . 0.409 ' C ' HG22 ' A' ' 30' ' ' ILE . 15.4 m-85 -123.49 -47.66 1.97 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.851 179.908 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.411 ' HA2' HD12 ' A' ' 30' ' ' ILE . . . 119.22 139.21 5.95 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.418 -179.888 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 78.04 -111.3 3.22 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.747 179.874 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -117.86 -4.14 11.14 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.721 0.296 . . . . 0.0 111.152 -179.81 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 6.5 mtt180 -55.57 -26.14 41.9 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.985 -179.896 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 69.01 -173.65 34.83 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.536 179.908 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . 0.579 ' CD1' ' O ' ' A' ' 54' ' ' PHE . 29.5 p90 -129.68 122.65 29.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.893 0.378 . . . . 0.0 111.007 -179.952 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -91.2 147.73 22.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.489 179.795 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.462 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.8 OUTLIER -137.35 156.51 48.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.926 0.393 . . . . 0.0 111.181 -179.834 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -144.59 133.56 22.63 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.797 179.923 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 22.9 t -37.43 130.52 0.95 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.057 179.972 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -39.09 118.68 1.15 Allowed Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.87 179.899 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_exo -51.45 152.74 11.49 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.685 2.257 . . . . 0.0 112.232 179.929 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -50.54 -54.13 24.88 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.088 -179.94 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -111.21 122.76 48.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.135 -179.943 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.441 ' O ' ' O ' ' A' ' 97' ' ' ALA . 1.2 tt0 -113.91 -43.69 3.24 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.505 179.977 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.436 ' HG2' ' CG1' ' A' ' 77' ' ' VAL . 12.1 mt-10 -64.34 82.57 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.899 -179.77 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.408 ' O ' ' N ' ' A' ' 98' ' ' GLY . 0.0 OUTLIER -177.24 166.32 2.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.192 179.899 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -158.9 178.76 9.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.9 -179.817 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.437 ' O ' ' N ' ' A' ' 69' ' ' LYS . 44.8 t80 -131.49 85.04 2.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.883 179.985 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . 0.51 ' O ' ' N ' ' A' ' 72' ' ' GLY . 10.1 p-10 -53.65 86.83 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.964 179.994 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 69' ' ' LYS . . . . . 0.437 ' N ' ' O ' ' A' ' 67' ' ' PHE . 0.1 OUTLIER -40.32 -46.95 2.43 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.914 179.933 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . 0.411 ' C ' ' O ' ' A' ' 69' ' ' LYS . 8.7 m-30 -36.59 -74.94 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.954 179.928 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -93.79 -41.38 9.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.019 -179.976 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 72' ' ' GLY . . . . . 0.51 ' N ' ' O ' ' A' ' 68' ' ' ASP . . . 108.02 -3.44 33.61 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.661 -0.781 . . . . 0.0 112.468 -179.994 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . 0.492 ' N ' ' OD1' ' A' ' 73' ' ' ASN . 0.3 OUTLIER -73.21 102.57 3.67 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.836 0.351 . . . . 0.0 110.848 -179.982 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.403 HG23 ' N ' ' A' ' 75' ' ' TYR . 93.1 m -41.69 134.39 2.48 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.081 179.941 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 75' ' ' TYR . . . . . 0.403 ' N ' HG23 ' A' ' 74' ' ' THR . 14.3 m-85 -122.76 -174.26 2.88 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.739 179.959 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -117.7 149.46 40.7 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.804 179.94 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.436 ' CG1' ' HG2' ' A' ' 64' ' ' GLU . 9.6 p -63.08 -28.73 45.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.085 -179.991 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -91.69 11.13 72.99 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.518 179.872 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -126.07 153.9 43.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.836 0.351 . . . . 0.0 110.897 179.99 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -127.07 167.68 15.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.152 -179.883 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.411 ' N ' ' CD1' ' A' ' 81' ' ' TYR . 0.5 OUTLIER -149.56 154.1 38.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.885 -179.98 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -102.4 164.59 11.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.941 179.959 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 169.95 121.96 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.769 -179.998 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 84' ' ' PRO . . . . . 0.435 ' HA ' ' HA ' ' A' ' 89' ' ' ILE . 45.4 Cg_endo -68.45 161.49 44.7 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.73 2.287 . . . . 0.0 112.421 -179.962 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.432 ' O ' ' NE1' ' A' ' 90' ' ' TRP . 11.4 tptt 173.86 161.98 0.17 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.897 179.973 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 86' ' ' ASP . . . . . 0.489 ' O ' ' CB ' ' A' ' 87' ' ' SER . 1.1 m-20 56.81 19.97 4.84 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.934 -179.98 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 87' ' ' SER . . . . . 0.489 ' CB ' ' O ' ' A' ' 86' ' ' ASP . 1.4 t 82.16 18.61 0.35 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.876 -179.993 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 88' ' ' MET . . . . . 0.414 ' O ' ' O ' ' A' ' 85' ' ' LYS . 5.6 ttm -162.2 172.68 15.39 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.958 -179.941 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 89' ' ' ILE . . . . . 0.507 ' C ' ' CD1' ' A' ' 90' ' ' TRP . 2.8 mt -96.75 141.85 14.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.054 179.912 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 90' ' ' TRP . . . . . 0.573 ' CE3' ' HB ' ' A' ' 106' ' ' ILE . 0.5 OUTLIER -142.89 84.61 1.85 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.84 -179.985 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -38.88 92.23 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.715 -179.935 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . 0.505 ' N ' ' O ' ' A' ' 90' ' ' TRP . 0.1 OUTLIER -81.73 129.29 34.67 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.013 -179.955 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.456 ' O ' HG13 ' A' ' 95' ' ' ILE . 63.3 m -114.8 135.66 53.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.086 179.905 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 6.7 t -59.6 88.67 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.097 -179.91 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . 0.456 HG13 ' O ' ' A' ' 93' ' ' THR . 1.3 mt -109.34 87.93 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.282 -179.874 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -176.76 -39.71 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.848 -0.692 . . . . 0.0 112.515 179.942 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 97' ' ' ALA . . . . . 0.441 ' O ' ' O ' ' A' ' 63' ' ' GLU . . . 62.68 35.04 14.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.842 0.353 . . . . 0.0 111.205 179.932 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 98' ' ' GLY . . . . . 0.452 ' O ' ' HD3' ' A' ' 99' ' ' ARG . . . 140.42 -10.52 2.97 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.59 -0.814 . . . . 0.0 112.677 179.952 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.452 ' HD3' ' O ' ' A' ' 98' ' ' GLY . 0.2 OUTLIER 176.49 -83.29 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.805 0.336 . . . . 0.0 110.793 -179.899 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . 0.469 ' O ' ' HB3' ' A' ' 101' ' ' ARG . . . 35.54 -108.32 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.546 179.965 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.564 ' CD ' ' N ' ' A' ' 101' ' ' ARG . 0.0 OUTLIER 176.95 104.59 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.841 0.353 . . . . 0.0 110.92 179.983 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 2.7 mp -52.2 116.42 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.222 179.986 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 103' ' ' SER . . . . . 0.463 ' O ' ' HA ' ' A' ' 92' ' ' CYS . 3.8 t -82.26 139.74 34.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.771 179.911 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -114.91 113.41 24.14 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.997 -179.875 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 1.4 p -97.02 109.4 22.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.048 179.809 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . 0.573 ' HB ' ' CE3' ' A' ' 90' ' ' TRP . 0.0 OUTLIER -58.53 150.29 4.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.338 -179.927 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 107' ' ' ALA . . . . . 0.519 ' N ' HD11 ' A' ' 106' ' ' ILE . . . -99.98 126.84 46.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.946 179.822 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 -109.22 -13.25 14.68 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.036 -179.901 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.214 -0.898 . . . . 0.0 110.794 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo . . . . . 0 C--O 1.231 0.15 0 CA-C-O 120.868 0.278 . . . . 0.0 112.432 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 119.11 177.17 16.48 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.513 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -143.1 107.19 4.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.821 0.343 . . . . 0.0 111.046 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -96.37 118.16 32.34 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.691 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.4 ' OD2' ' CD ' ' A' ' 36' ' ' ARG . 0.2 OUTLIER -149.52 149.69 31.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.963 -179.944 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 39.8 t30 47.14 30.12 1.3 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.95 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 71.36 16.87 75.7 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.546 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.459 ' HB3' ' CZ ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -115.14 155.74 26.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.821 0.343 . . . . 0.0 110.823 -179.991 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 18.6 t-80 -111.38 83.97 1.86 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.151 -179.713 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.459 ' CZ ' ' HB3' ' A' ' 26' ' ' LYS . 0.9 OUTLIER -82.6 173.68 11.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.784 179.746 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.524 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 1.0 OUTLIER -109.74 140.92 43.07 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.596 179.709 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.66 HD12 ' H ' ' A' ' 30' ' ' ILE . 4.0 mp -36.47 151.62 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.207 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.452 ' HB2' ' O ' ' A' ' 30' ' ' ILE . 29.7 m-80 66.53 13.22 9.19 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.789 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.524 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 13.4 tt0 -100.46 149.16 23.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.844 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.46 ' HG2' ' OG1' ' A' ' 46' ' ' THR . 14.1 mt-30 -115.99 143.93 44.77 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.178 -179.715 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' TRP . . . . . 0.589 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 37.6 p90 -145.69 162.43 37.57 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.6 179.616 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -100.0 128.19 46.11 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.979 0.419 . . . . 0.0 111.439 -179.519 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.4 ' CD ' ' OD2' ' A' ' 23' ' ' ASP . 0.0 OUTLIER -132.2 -163.26 1.31 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.278 179.527 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.46 ' HA ' ' O ' ' A' ' 41' ' ' ASN . 1.2 t -147.46 134.73 20.6 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.822 0.344 . . . . 0.0 111.244 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.945 ' HB2' HD22 ' A' ' 43' ' ' LEU . 0.3 OUTLIER -90.02 89.67 7.8 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.486 179.71 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.499 ' CB ' ' O ' ' A' ' 38' ' ' TYR . 1.4 tp 82.89 -48.42 0.16 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.721 -179.729 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 178.53 34.9 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.867 -0.683 . . . . 0.0 112.557 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.46 ' O ' ' HA ' ' A' ' 37' ' ' THR . 85.9 m-20 -148.18 148.59 30.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.659 0.266 . . . . 0.0 110.934 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.434 ' C ' ' O ' ' A' ' 41' ' ' ASN . . . -36.53 141.96 0.1 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.695 179.737 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.945 HD22 ' HB2' ' A' ' 38' ' ' TYR . 21.9 tp -169.92 99.38 0.3 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.85 0.357 . . . . 0.0 111.27 -179.567 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.509 ' N ' ' O ' ' A' ' 57' ' ' GLU . 24.8 t -75.92 159.53 5.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.569 179.492 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.589 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 0.0 OUTLIER -140.77 144.91 35.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.856 0.36 . . . . 0.0 111.266 -179.769 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.46 ' OG1' ' HG2' ' A' ' 33' ' ' GLN . 86.1 m -129.66 123.48 31.31 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.915 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.477 ' SG ' ' HA ' ' A' ' 30' ' ' ILE . 30.3 t -80.63 137.61 36.36 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.002 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.437 ' CE1' ' O ' ' A' ' 46' ' ' THR . 5.5 m-85 -117.05 -2.27 11.75 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.975 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.561 ' N ' HG23 ' A' ' 30' ' ' ILE . . . 135.02 -173.62 21.51 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.438 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -85.13 -11.12 76.79 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.485 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -109.49 -44.32 3.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.819 0.342 . . . . 0.0 110.954 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 3.9 mtt180 -73.38 -29.39 62.59 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.049 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 75.26 -156.45 48.68 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.549 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.534 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 12.1 p90 -134.07 150.0 51.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.889 0.376 . . . . 0.0 110.952 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -120.46 104.39 9.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.839 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.478 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 1.2 m -67.48 163.78 20.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.936 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.632 ' C ' HD12 ' A' ' 43' ' ' LEU . 0.2 OUTLIER -166.6 142.34 4.53 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.862 179.889 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.48 ' N ' HD12 ' A' ' 43' ' ' LEU . 3.4 m -69.38 146.49 52.05 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.879 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.426 ' C ' ' O ' ' A' ' 58' ' ' SER . 0.9 OUTLIER . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.871 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.509 ' O ' ' CB ' ' A' ' 64' ' ' GLU . 3.0 tt0 . . . . . 0 N--CA 1.455 -0.183 0 CA-C-O 120.729 0.3 . . . . 0.0 110.572 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.664 ' O ' HG23 ' A' ' 65' ' ' THR . 3.6 mt-10 159.37 63.05 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.078 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.664 HG23 ' O ' ' A' ' 64' ' ' GLU . 0.1 OUTLIER 170.66 154.54 0.06 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.13 179.958 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 17.8 m -126.07 -154.55 0.63 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.835 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.406 ' O ' ' N ' ' A' ' 73' ' ' ASN . 44.6 t80 -158.3 -40.31 0.06 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.024 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ASP . . . . . 0.515 ' O ' ' N ' ' A' ' 72' ' ' GLY . 3.7 t0 71.01 70.07 0.18 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.968 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -43.05 -29.41 0.35 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.915 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' TYR . . . . . 0.584 ' CE2' ' HE3' ' A' ' 85' ' ' LYS . 7.5 m-30 -53.28 -54.18 40.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.947 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 25.4 m -119.97 -36.5 3.26 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.072 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' GLY . . . . . 0.515 ' N ' ' O ' ' A' ' 68' ' ' ASP . . . 97.79 47.71 2.06 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.439 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ASN . . . . . 0.491 ' HB3' ' CZ ' ' A' ' 75' ' ' TYR . 0.4 OUTLIER -96.77 -172.56 2.5 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.787 0.327 . . . . 0.0 110.844 -179.979 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.491 ' O ' ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -120.78 117.99 28.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.016 179.913 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.491 ' CZ ' ' HB3' ' A' ' 73' ' ' ASN . 9.6 m-85 -136.87 144.75 43.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.906 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -83.53 165.19 19.31 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.961 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 13.5 p -81.11 -18.46 11.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.169 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -100.92 42.96 1.82 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.509 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -164.21 133.1 3.7 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.813 0.34 . . . . 0.0 110.964 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 58.2 p -93.6 163.72 13.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.187 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 33.2 p90 -160.65 110.7 1.75 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.856 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -55.5 160.5 2.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.021 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.422 ' HA ' ' HD2' ' A' ' 84' ' ' PRO . 0.0 OUTLIER -148.91 96.59 3.75 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.8 179.888 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.422 ' HD2' ' HA ' ' A' ' 83' ' ' ARG . 36.8 Cg_endo -65.79 114.91 3.14 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.769 2.312 . . . . 0.0 112.333 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.584 ' HE3' ' CE2' ' A' ' 70' ' ' TYR . 0.5 OUTLIER -141.67 111.14 6.46 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.839 -179.978 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.454 ' CB ' ' O ' ' A' ' 85' ' ' LYS . 0.9 OUTLIER 80.65 -159.16 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.768 -179.963 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 87' ' ' SER . . . . . 0.445 ' O ' ' OG ' ' A' ' 87' ' ' SER . 2.3 t -89.85 17.32 6.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.919 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' MET . . . . . 0.581 ' HG2' ' CZ2' ' A' ' 90' ' ' TRP . 16.5 tpp -131.61 129.74 41.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.829 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -92.03 139.29 18.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.177 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' TRP . . . . . 0.581 ' CZ2' ' HG2' ' A' ' 88' ' ' MET . 1.7 m95 -136.4 152.21 50.37 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.823 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -104.89 87.65 2.71 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.842 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 73.2 m -67.26 140.71 57.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.013 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.569 HG22 HG12 ' A' ' 95' ' ' ILE . 86.6 m -123.94 122.53 38.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.127 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.448 ' SG ' ' HB2' ' A' ' 75' ' ' TYR . 0.0 OUTLIER -63.08 69.65 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.798 -179.993 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.569 HG12 HG22 ' A' ' 93' ' ' THR . 1.2 mt -89.64 46.89 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.353 -179.845 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.454 ' HA2' ' HA2' ' A' ' 100' ' ' GLY . . . -52.4 -81.59 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.484 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.409 ' HA ' ' HG3' ' A' ' 63' ' ' GLU . . . 61.38 -89.05 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.811 0.338 . . . . 0.0 111.098 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -71.11 -30.59 67.39 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.488 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 9.1 ttt180 -174.87 -67.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.846 0.355 . . . . 0.0 110.923 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 0.454 ' HA2' ' HA2' ' A' ' 96' ' ' GLY . . . -167.84 91.05 0.1 OUTLIER Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.486 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 4.5 ttt85 -109.25 42.28 1.48 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.808 0.337 . . . . 0.0 110.971 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.403 ' HA ' ' O ' ' A' ' 93' ' ' THR . 1.2 mp -52.55 95.9 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.193 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 47.5 t -86.48 123.53 31.8 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.913 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 46.2 m -116.02 101.03 8.38 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.844 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 14.0 t -110.98 142.14 43.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.133 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.579 ' H ' HD12 ' A' ' 106' ' ' ILE . 4.6 mp -44.26 149.05 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.987 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -49.09 139.9 10.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.881 0.372 . . . . 0.0 111.104 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -68.23 -33.28 74.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.897 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.228 -0.891 . . . . 0.0 110.938 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.415 ' HB2' HD11 ' A' ' 30' ' ' ILE . 45.0 Cg_exo . . . . . 0 C--O 1.231 0.137 0 CA-C-O 120.814 0.256 . . . . 0.0 112.262 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.37 162.82 3.28 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.665 -0.779 . . . . 0.0 112.474 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 25.0 m -127.4 106.85 9.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.87 0.367 . . . . 0.0 110.846 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 32.6 t80 -86.25 120.87 28.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.985 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.452 ' OD1' ' CB ' ' A' ' 26' ' ' LYS . 3.6 p-10 -97.42 -160.29 0.79 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.866 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.429 ' C ' ' O ' ' A' ' 23' ' ' ASP . 0.4 OUTLIER -34.96 -75.67 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.976 -0.557 . . . . 0.0 111.008 -179.983 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -133.64 33.78 2.51 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.632 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.517 ' HB3' ' CE2' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -140.16 141.17 36.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.836 0.351 . . . . 0.0 110.969 -179.997 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 10.4 t-160 -120.44 90.14 3.27 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.968 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.625 ' CE2' ' CB ' ' A' ' 34' ' ' TRP . 93.1 m-85 -87.26 161.64 17.88 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.094 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.532 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 3.6 tt0 -87.56 156.38 19.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.803 179.829 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.705 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.9 mp -44.45 147.73 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.437 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 24.0 m-80 65.03 13.43 8.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.162 179.704 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.532 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 1.0 OUTLIER -99.74 148.6 24.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.879 0.371 . . . . 0.0 110.781 179.851 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -115.96 151.0 36.25 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.913 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' TRP . . . . . 0.625 ' CB ' ' CE2' ' A' ' 28' ' ' TYR . 42.6 p90 -152.65 -174.45 4.92 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.902 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -114.61 132.45 56.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.019 -179.802 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.529 ' O ' ' CB ' ' A' ' 43' ' ' LEU . 3.1 ttt180 -139.22 165.92 25.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.725 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.401 ' OG1' ' C ' ' A' ' 41' ' ' ASN . 2.2 t -136.92 135.9 38.15 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.917 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.797 ' CE1' HD13 ' A' ' 39' ' ' LEU . 1.1 t80 -118.37 125.32 49.76 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.773 179.903 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.797 HD13 ' CE1' ' A' ' 38' ' ' TYR . 0.8 OUTLIER 65.36 14.42 9.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.605 -179.737 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 87.45 44.61 5.51 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.58 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.427 ' O ' ' C ' ' A' ' 42' ' ' ALA . 27.2 m-80 -144.09 125.5 14.8 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.751 0.31 . . . . 0.0 110.89 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.459 ' O ' ' CD1' ' A' ' 43' ' ' LEU . . . -35.04 147.57 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.945 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.529 ' CB ' ' O ' ' A' ' 36' ' ' ARG . 1.5 tp -165.49 157.78 15.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.988 0.423 . . . . 0.0 111.297 -179.686 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.479 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 3.6 t -126.2 135.46 63.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.335 179.382 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.593 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 0.5 OUTLIER -118.79 162.45 18.45 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.428 -179.486 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 20.5 m -147.69 131.14 16.68 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.895 179.799 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.501 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 14.3 t -91.35 132.26 36.3 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.882 0.372 . . . . 0.0 111.052 -179.85 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.499 ' HB2' ' HB3' ' A' ' 52' ' ' ARG . 2.0 m-85 -105.17 -35.96 7.42 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.783 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.515 ' HA3' ' CG2' ' A' ' 30' ' ' ILE . . . 76.63 173.08 36.63 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.489 -179.932 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLY . . . . . 0.52 ' O ' ' CB ' ' A' ' 51' ' ' SER . . . 66.91 18.0 68.15 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.64 -0.79 . . . . 0.0 112.532 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' SER . . . . . 0.52 ' CB ' ' O ' ' A' ' 50' ' ' GLY . 1.0 OUTLIER 85.78 -0.56 0.73 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.671 0.272 . . . . 0.0 111.208 179.964 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.499 ' HB3' ' HB2' ' A' ' 48' ' ' TYR . 0.0 OUTLIER -56.87 -27.91 61.07 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.937 0.399 . . . . 0.0 110.882 179.942 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 74.45 129.5 0.19 Allowed Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.67 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.559 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 10.3 p90 -63.97 177.63 0.75 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.843 0.354 . . . . 0.0 110.825 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 79.3 m-20 -152.01 123.92 8.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.929 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.479 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.8 OUTLIER -104.56 155.88 18.45 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.908 179.951 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -170.5 171.75 6.31 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.019 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.432 ' HA ' HD12 ' A' ' 43' ' ' LEU . 0.1 OUTLIER -57.28 136.44 56.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.932 -179.975 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.3 tppp? . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.054 179.963 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.455 -0.202 0 CA-C-O 120.781 0.324 . . . . 0.0 110.499 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.508 ' HG3' ' CG2' ' A' ' 77' ' ' VAL . 23.2 tt0 -95.85 57.03 1.78 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.904 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.46 HG23 ' O ' ' A' ' 64' ' ' GLU . 22.4 p -157.06 -174.97 5.17 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.194 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -144.7 -165.19 2.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.844 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 86.9 t80 -163.83 97.94 0.86 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.819 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ASP . . . . . 0.486 ' O ' ' N ' ' A' ' 72' ' ' GLY . 3.9 m-20 -72.26 83.57 1.04 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.962 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -39.41 -30.25 0.06 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.882 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 39.0 m-85 -57.45 -61.69 2.31 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.948 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 24.9 p -112.09 19.51 17.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.105 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' GLY . . . . . 0.486 ' N ' ' O ' ' A' ' 68' ' ' ASP . . . 38.69 54.96 2.24 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.547 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 -124.22 160.19 28.46 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.835 0.35 . . . . 0.0 110.702 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.52 155.81 17.64 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.19 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 25.5 m-85 -139.09 -172.09 3.25 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.836 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -104.83 155.75 18.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.939 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.528 HG13 ' O ' ' A' ' 94' ' ' CYS . 2.5 t -90.63 25.73 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.071 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -138.44 17.85 3.29 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.62 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -142.04 136.71 30.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.819 0.342 . . . . 0.0 110.974 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.455 HG22 HG23 ' A' ' 93' ' ' THR . 1.4 p -93.67 114.08 26.3 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.116 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' TYR . . . . . 0.571 ' OH ' HD13 ' A' ' 102' ' ' ILE . 42.5 p90 -102.93 136.47 42.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.883 -179.935 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 90.1 mt-10 -97.37 164.73 12.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.72 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.79 117.68 1.93 Allowed Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.912 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -70.86 103.42 1.34 Allowed 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.671 2.247 . . . . 0.0 112.299 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -134.28 161.65 34.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.986 -179.899 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 51.4 31.08 6.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.932 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 71.34 5.36 5.41 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.087 179.934 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -132.62 178.57 6.74 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.924 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.503 ' C ' ' CD1' ' A' ' 90' ' ' TRP . 1.1 mt -116.67 145.33 22.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.076 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' TRP . . . . . 0.631 ' CZ3' ' CD1' ' A' ' 106' ' ' ILE . 0.0 OUTLIER -144.65 128.56 17.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.908 179.972 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.473 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 3.9 p30 -66.88 95.07 0.35 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.744 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' CYS . . . . . 0.505 ' O ' ' CD1' ' A' ' 81' ' ' TYR . 64.5 m -79.21 96.17 5.83 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.805 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.455 HG23 HG22 ' A' ' 80' ' ' THR . 2.6 m -74.83 148.45 40.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.017 179.934 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.797 ' HA ' HG22 ' A' ' 102' ' ' ILE . 0.1 OUTLIER -96.8 51.01 1.13 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.916 -179.923 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 1.8 mt -44.85 -40.56 2.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.104 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.668 ' O ' ' HB3' ' A' ' 97' ' ' ALA . . . 44.37 -163.08 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.502 179.925 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.668 ' HB3' ' O ' ' A' ' 96' ' ' GLY . . . 83.7 94.84 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.798 0.332 . . . . 0.0 111.075 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 117.67 -62.3 0.42 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.493 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.67 34.59 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.797 0.332 . . . . 0.0 110.88 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 0.449 ' HA2' ' HA2' ' A' ' 96' ' ' GLY . . . 55.16 79.68 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.556 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.518 ' O ' ' CG ' ' A' ' 101' ' ' ARG . 1.4 tmt_? -106.9 56.77 0.64 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.843 0.354 . . . . 0.0 110.862 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.797 HG22 ' HA ' ' A' ' 94' ' ' CYS . 0.8 OUTLIER -50.3 139.74 4.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.288 -179.922 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 12.1 t -115.84 129.69 56.53 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.745 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.471 ' HB3' ' HB2' ' A' ' 90' ' ' TRP . 8.9 m -118.58 143.38 46.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.002 -179.842 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' THR . . . . . 0.474 ' O ' ' HA ' ' A' ' 90' ' ' TRP . 0.3 OUTLIER -151.65 153.77 35.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.039 179.913 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.631 ' CD1' ' CZ3' ' A' ' 90' ' ' TRP . 2.8 mp -59.71 156.6 2.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.311 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.477 ' N ' HG22 ' A' ' 106' ' ' ILE . . . 46.51 -178.57 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.292 179.856 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -97.58 40.78 1.14 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.847 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.102 0 CA-C-O 118.299 -0.858 . . . . 0.0 110.91 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.702 ' HB2' HD11 ' A' ' 30' ' ' ILE . 41.6 Cg_endo . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.794 0.248 . . . . 0.0 112.348 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 154.5 -163.13 31.04 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.684 -0.769 . . . . 0.0 112.536 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 80.4 m -139.39 72.65 1.41 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.818 0.342 . . . . 0.0 110.893 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 30.8 t80 -52.5 117.96 3.25 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.815 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -164.86 150.26 9.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.885 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.435 ' CG ' ' O ' ' A' ' 24' ' ' ASN . 28.1 t-20 62.25 26.66 15.98 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.904 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 72.2 11.31 75.23 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.592 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.585 ' HB3' ' CE1' ' A' ' 28' ' ' TYR . 0.4 OUTLIER -122.12 151.59 40.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.814 0.34 . . . . 0.0 110.863 -179.923 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 5.1 t-160 -111.92 89.98 3.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.085 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.585 ' CE1' ' HB3' ' A' ' 26' ' ' LYS . 3.5 m-85 -79.62 171.02 15.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.028 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.529 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 0.9 OUTLIER -111.92 139.26 47.56 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.82 179.915 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.702 HD11 ' HB2' ' A' ' 19' ' ' PRO . 3.9 mp -35.0 140.38 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.534 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 13.5 m-20 72.62 8.75 5.65 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.15 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.529 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 56.1 tt0 -97.82 155.24 17.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.849 0.357 . . . . 0.0 111.057 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.623 ' CG ' HG23 ' A' ' 46' ' ' THR . 28.5 mt-30 -118.05 156.99 27.64 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.867 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' TRP . . . . . 0.588 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 38.2 p90 -155.35 166.95 31.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.707 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -99.77 123.13 43.72 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.169 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.62 -163.91 0.92 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.609 179.754 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.585 HG23 ' O ' ' A' ' 37' ' ' THR . 3.4 t -167.08 32.37 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.353 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.732 ' HB2' HD22 ' A' ' 43' ' ' LEU . 0.2 OUTLIER -40.33 143.87 0.27 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.847 179.905 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.463 ' HB2' ' O ' ' A' ' 38' ' ' TYR . 2.3 mm? 66.5 16.5 10.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.857 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 66.95 42.07 92.94 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.524 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.464 ' O ' ' HA ' ' A' ' 37' ' ' THR . 51.6 m-80 -152.23 132.11 13.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.596 0.236 . . . . 0.0 110.781 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.772 ' O ' HD12 ' A' ' 43' ' ' LEU . . . -31.01 135.1 0.06 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.458 -179.761 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.93 HD23 ' HB3' ' A' ' 56' ' ' CYS . 0.7 OUTLIER -153.86 174.66 14.3 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.13 -179.732 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.503 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.6 t -144.88 127.05 9.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.478 179.541 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.588 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 0.8 OUTLIER -117.72 163.41 16.52 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.383 -179.528 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.623 HG23 ' CG ' ' A' ' 33' ' ' GLN . 2.0 m -145.13 134.81 23.42 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.926 179.78 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.57 ' N ' ' CH2' ' A' ' 34' ' ' TRP . 14.0 t -82.58 135.13 35.15 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.928 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.47 ' C ' HG23 ' A' ' 30' ' ' ILE . 2.2 m-85 -110.62 -32.35 6.92 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.881 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 92.03 -166.95 30.16 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.519 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 42.0 -114.73 0.73 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.751 -0.737 . . . . 0.0 112.631 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -126.07 1.63 7.22 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.659 0.266 . . . . 0.0 111.208 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.508 ' NE ' ' HA ' ' A' ' 52' ' ' ARG . 0.1 OUTLIER -59.25 -38.39 79.95 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.785 0.326 . . . . 0.0 110.98 -179.923 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 70.59 141.34 0.19 Allowed Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.631 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.574 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 7.7 p90 -59.7 172.97 0.62 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.848 0.356 . . . . 0.0 110.807 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -156.06 108.35 2.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.762 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.93 ' HB3' HD23 ' A' ' 43' ' ' LEU . 2.1 m -75.5 172.18 12.98 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.032 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -141.28 -94.06 0.14 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.125 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.9 t 178.86 131.33 0.08 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.874 0.369 . . . . 0.0 110.917 -179.889 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.595 ' CB ' ' HB1' ' A' ' 42' ' ' ALA . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.792 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 . . . . . 0 N--CA 1.455 -0.18 0 CA-C-O 120.777 0.322 . . . . 0.0 110.57 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 72.77 -172.65 0.14 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.947 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.447 ' HA ' ' O ' ' A' ' 75' ' ' TYR . 24.4 p 48.83 -167.03 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.02 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.625 ' O ' HG23 ' A' ' 74' ' ' THR . 5.7 p 167.23 177.8 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.962 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 38.3 t80 -129.36 111.53 12.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.906 179.89 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -79.38 94.13 5.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.926 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.434 ' HB3' ' CE1' ' A' ' 70' ' ' TYR . 0.1 OUTLIER -51.87 173.91 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.749 179.925 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 70' ' ' TYR . . . . . 0.481 ' CD1' ' N ' ' A' ' 70' ' ' TYR . 0.8 OUTLIER 76.19 -54.58 0.6 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.815 -179.961 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -107.22 -17.57 14.12 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.108 179.909 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 54.07 72.72 0.5 Allowed Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.48 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -140.83 96.27 2.99 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.789 0.328 . . . . 0.0 110.838 -179.898 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.625 HG23 ' O ' ' A' ' 66' ' ' CYS . 85.0 m -50.74 135.99 22.69 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.033 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.447 ' O ' ' HA ' ' A' ' 65' ' ' THR . 21.9 m-85 -129.47 175.3 8.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.893 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.09 133.84 41.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.826 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.402 ' HA ' ' O ' ' A' ' 94' ' ' CYS . 7.1 p -46.4 -39.77 3.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.029 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -94.99 33.14 5.57 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.472 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -135.13 114.67 12.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.882 0.373 . . . . 0.0 110.955 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.608 HG22 HG23 ' A' ' 93' ' ' THR . 44.9 p -86.36 150.31 24.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.163 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' TYR . . . . . 0.524 ' CE1' ' HB3' ' A' ' 92' ' ' CYS . 32.9 p90 -139.4 -178.6 5.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.808 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.412 ' OE2' ' OD1' ' A' ' 108' ' ' ASN . 1.9 mp0 -115.97 151.38 35.54 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.888 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 14.7 ttm180 -139.31 101.03 7.59 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.96 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -75.34 113.71 3.83 Favored 'Trans proline' 0 N--CA 1.464 -0.264 0 C-N-CA 122.798 2.332 . . . . 0.0 112.364 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.7 mtpp -157.34 161.95 39.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.924 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 50.06 25.5 1.73 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.871 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.2 t 72.98 8.11 5.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.041 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' MET . . . . . 0.447 ' O ' ' NE1' ' A' ' 90' ' ' TRP . 0.0 OUTLIER -138.57 134.02 33.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.955 179.991 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.54 ' C ' ' CD1' ' A' ' 90' ' ' TRP . 2.8 mp -85.3 157.97 3.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.058 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' TRP . . . . . 0.55 ' CH2' HD11 ' A' ' 106' ' ' ILE . 4.5 m95 -148.89 107.95 3.89 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.95 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.507 ' N ' ' O ' ' A' ' 105' ' ' THR . 11.1 t70 -58.58 91.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.785 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' CYS . . . . . 0.524 ' HB3' ' CE1' ' A' ' 81' ' ' TYR . 0.8 OUTLIER -74.46 150.49 39.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.134 -179.939 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.608 HG23 HG22 ' A' ' 80' ' ' THR . 41.7 m -127.49 108.1 10.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.993 179.875 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.402 ' O ' ' HA ' ' A' ' 77' ' ' VAL . 20.3 t -53.85 82.35 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.948 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.52 ' N ' ' O ' ' A' ' 93' ' ' THR . 1.5 mt -77.89 -26.57 14.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.216 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.45 ' HA3' ' HA3' ' A' ' 100' ' ' GLY . . . -158.42 164.03 33.26 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.514 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.457 ' O ' ' N ' ' A' ' 99' ' ' ARG . . . -91.92 104.14 16.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.781 0.324 . . . . 0.0 111.098 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 36.95 30.7 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.479 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.457 ' N ' ' O ' ' A' ' 97' ' ' ALA . 0.4 OUTLIER -147.98 -46.14 0.16 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.783 0.325 . . . . 0.0 110.935 -179.962 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 0.48 ' C ' ' CG ' ' A' ' 101' ' ' ARG . . . -65.08 -98.07 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.572 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.48 ' CG ' ' C ' ' A' ' 100' ' ' GLY . 0.0 OUTLIER 172.02 94.3 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.751 0.31 . . . . 0.0 110.95 -179.987 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 43.0 mt -72.07 78.15 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.125 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.461 ' O ' ' HA ' ' A' ' 92' ' ' CYS . 1.4 t -54.93 151.06 9.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.078 -179.915 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.485 ' SG ' ' HB2' ' A' ' 90' ' ' TRP . 0.0 OUTLIER -130.31 150.99 51.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.75 179.924 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 105' ' ' THR . . . . . 0.507 ' O ' ' N ' ' A' ' 91' ' ' ASP . 0.2 OUTLIER -167.28 134.2 2.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.916 0.389 . . . . 0.0 111.356 -179.947 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.55 HD11 ' CH2' ' A' ' 90' ' ' TRP . 1.2 mp -66.57 165.25 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.118 179.863 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.509 ' N ' HG22 ' A' ' 106' ' ' ILE . . . 68.61 120.08 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.142 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 108' ' ' ASN . . . . . 0.412 ' OD1' ' OE2' ' A' ' 82' ' ' GLU . 0.1 OUTLIER -88.73 76.45 8.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.943 -179.979 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 20.0 ttt85 . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.293 -0.861 . . . . 0.0 110.879 179.883 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_exo . . . . . 0 N--CA 1.465 -0.191 0 CA-C-O 120.881 0.284 . . . . 0.0 112.419 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 137.02 163.29 9.68 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.464 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.3 m -112.14 135.19 53.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.826 0.346 . . . . 0.0 110.914 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -115.09 115.68 27.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.85 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -160.21 159.92 32.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.853 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.428 ' O ' ' CG ' ' A' ' 24' ' ' ASN . 28.3 t-20 58.8 25.19 13.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.9 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 72.89 7.27 69.83 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.443 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.496 ' HB3' ' CZ ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -122.91 142.3 50.95 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.756 0.312 . . . . 0.0 111.004 179.963 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 2.9 t-160 -114.49 88.28 2.82 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.862 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.496 ' CZ ' ' HB3' ' A' ' 26' ' ' LYS . 0.5 OUTLIER -79.63 -170.28 2.3 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.939 -179.939 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.493 ' O ' ' HB2' ' A' ' 32' ' ' GLN . 0.0 OUTLIER -102.12 173.24 6.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.953 -179.962 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.713 HD12 ' H ' ' A' ' 30' ' ' ILE . 2.9 mp -66.4 155.63 7.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.469 -179.777 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 85.7 m-20 53.78 18.02 1.44 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.202 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.493 ' HB2' ' O ' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -95.29 151.46 19.23 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.668 179.823 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 14.9 mt-30 -115.8 144.77 43.53 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.101 -179.732 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' TRP . . . . . 0.549 ' CZ3' ' HB2' ' A' ' 47' ' ' CYS . 41.2 p90 -148.9 178.78 8.38 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.753 179.663 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -103.11 129.87 50.1 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.025 0.441 . . . . 0.0 111.28 -179.715 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.528 ' O ' ' N ' ' A' ' 43' ' ' LEU . 32.5 ttt-85 -132.99 170.66 15.04 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.296 179.558 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.485 ' HA ' ' HB2' ' A' ' 43' ' ' LEU . 1.2 t -139.46 132.78 29.99 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.872 0.368 . . . . 0.0 111.477 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.512 ' CB ' HD22 ' A' ' 43' ' ' LEU . 45.9 t80 -124.05 124.21 42.04 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.655 179.793 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 70.33 22.37 5.39 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.989 0.424 . . . . 0.0 110.478 -179.711 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 76.4 41.06 26.53 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.923 -0.656 . . . . 0.0 112.501 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.441 ' C ' ' HG1' ' A' ' 37' ' ' THR . 69.0 m-80 -145.46 138.08 25.92 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.819 0.342 . . . . 0.0 111.254 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -37.75 152.31 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.876 179.827 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.528 ' N ' ' O ' ' A' ' 36' ' ' ARG . 2.2 tp -167.28 159.62 12.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.22 -179.839 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.503 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.6 t -130.24 129.11 64.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.661 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.567 ' SG ' ' CD1' ' A' ' 54' ' ' PHE . 0.8 OUTLIER -110.75 163.53 13.68 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.32 -179.715 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 35.4 m -144.78 118.41 9.17 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.031 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.549 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 35.2 t -72.71 145.62 47.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.018 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.517 ' CB ' ' HB3' ' A' ' 52' ' ' ARG . 4.9 m-85 -119.39 -16.3 8.98 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.921 179.939 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.538 ' N ' HG23 ' A' ' 30' ' ' ILE . . . 92.57 179.95 40.5 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.505 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLY . . . . . 0.417 ' C ' ' O ' ' A' ' 49' ' ' GLY . . . 36.13 -107.8 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.482 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 28.4 t -131.67 7.79 4.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.776 0.322 . . . . 0.0 111.05 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.517 ' HB3' ' CB ' ' A' ' 48' ' ' TYR . 7.3 mmt180 -52.66 -19.77 2.61 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.966 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 68.62 151.59 0.38 Allowed Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.355 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.567 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 4.3 p90 -92.96 157.95 16.06 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.834 0.35 . . . . 0.0 110.945 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -116.87 115.6 25.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.623 179.824 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.503 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.1 OUTLIER -102.93 152.81 20.87 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.203 -179.778 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -175.26 179.49 1.51 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.814 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 26.7 t -73.9 135.14 43.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.925 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.462 ' CD ' HG21 ' A' ' 44' ' ' VAL . 3.9 tptp . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.931 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 . . . . . 0 N--CA 1.456 -0.17 0 CA-C-O 120.928 0.394 . . . . 0.0 110.468 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.01 -176.38 2.07 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.91 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.5 p 64.85 -162.27 0.27 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.198 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.469 ' O ' ' HA ' ' A' ' 74' ' ' THR . 29.0 m -160.19 157.6 28.58 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.857 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.429 ' O ' ' C ' ' A' ' 68' ' ' ASP . 71.2 t80 -110.14 -17.65 13.5 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.67 179.776 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ASP . . . . . 0.443 ' OD2' ' CE2' ' A' ' 81' ' ' TYR . 4.3 t0 35.52 93.56 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.027 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.577 ' O ' ' CD2' ' A' ' 70' ' ' TYR . 4.0 ptmt -52.87 -170.13 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.624 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' TYR . . . . . 0.577 ' CD2' ' O ' ' A' ' 69' ' ' LYS . 8.1 m-85 83.87 -56.4 0.14 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.837 0.351 . . . . 0.0 110.922 -179.829 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -134.45 17.55 3.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.159 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 45.14 58.68 4.92 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.391 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -89.61 164.86 14.57 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.811 0.339 . . . . 0.0 110.894 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.469 ' HA ' ' O ' ' A' ' 66' ' ' CYS . 0.9 OUTLIER -118.29 90.19 3.28 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.134 179.905 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 16.6 m-30 -97.94 -168.85 1.73 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.861 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.94 162.49 30.54 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.763 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 3.4 t -76.58 -22.92 15.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.134 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -92.18 15.04 63.01 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.566 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -151.53 113.73 4.54 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.771 0.319 . . . . 0.0 110.815 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.812 ' HB ' HG23 ' A' ' 93' ' ' THR . 1.3 t -74.18 179.43 4.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.12 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' TYR . . . . . 0.734 ' OH ' HG21 ' A' ' 102' ' ' ILE . 45.7 p90 -153.71 168.26 26.84 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.931 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -110.64 144.21 39.89 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.706 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.04 96.02 4.35 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.0 -179.888 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_exo -56.22 138.88 84.8 Favored 'Trans proline' 0 N--CA 1.466 -0.134 0 C-N-CA 122.836 2.357 . . . . 0.0 112.044 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.428 ' O ' ' N ' ' A' ' 87' ' ' SER . 0.2 OUTLIER -155.39 165.11 37.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.917 0.389 . . . . 0.0 111.095 -179.932 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 46.76 -92.7 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.024 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' SER . . . . . 0.428 ' N ' ' O ' ' A' ' 85' ' ' LYS . 0.8 OUTLIER -152.16 18.37 0.66 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.969 -179.964 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 88' ' ' MET . . . . . 0.408 ' CE ' ' HA ' ' A' ' 88' ' ' MET . 0.6 OUTLIER -147.1 167.45 24.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.878 -179.995 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.411 ' O ' ' N ' ' A' ' 107' ' ' ALA . 4.0 mt -107.39 140.34 26.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.063 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' TRP . . . . . 0.533 ' CD1' ' N ' ' A' ' 90' ' ' TRP . 0.7 OUTLIER -131.86 124.5 29.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.953 -179.868 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -67.1 72.08 0.1 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.742 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' CYS . . . . . 0.48 ' HA ' ' O ' ' A' ' 103' ' ' SER . 54.3 m -59.89 111.83 1.62 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.024 -179.845 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.812 HG23 ' HB ' ' A' ' 80' ' ' THR . 32.2 m -103.79 119.74 39.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.98 179.803 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.818 ' HA ' HD12 ' A' ' 102' ' ' ILE . 0.0 OUTLIER -58.53 80.53 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.832 -179.907 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.467 ' N ' ' O ' ' A' ' 93' ' ' THR . 2.1 mt -98.87 101.05 11.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.312 -179.84 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 144.66 176.19 18.45 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.5 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -69.23 58.82 0.11 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.837 0.351 . . . . 0.0 111.087 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.43 -23.47 15.53 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.559 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -176.58 55.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.846 0.355 . . . . 0.0 110.961 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -89.75 -37.16 6.99 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.39 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.517 ' O ' ' N ' ' A' ' 103' ' ' SER . 2.3 ptp85 -178.58 49.33 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.842 0.353 . . . . 0.0 110.74 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.818 HD12 ' HA ' ' A' ' 94' ' ' CYS . 10.4 mm -38.39 90.48 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.262 -179.903 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.517 ' N ' ' O ' ' A' ' 101' ' ' ARG . 21.9 t -69.08 174.2 4.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.603 179.777 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.451 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 20.1 m -155.76 124.35 5.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.032 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 2.9 p -92.89 104.67 16.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.108 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.507 HG13 ' CZ3' ' A' ' 90' ' ' TRP . 1.3 tt -43.99 151.0 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.083 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.411 ' N ' ' O ' ' A' ' 89' ' ' ILE . . . -121.91 126.25 48.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.063 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 22.1 p30 -147.49 173.14 12.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.888 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.284 -0.865 . . . . 0.0 110.866 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_exo . . . . . 0 N--CA 1.465 -0.158 0 CA-C-O 120.804 0.252 . . . . 0.0 112.303 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.18 -167.82 45.91 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.454 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 54.5 m -126.79 132.42 51.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.842 0.353 . . . . 0.0 110.938 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 11.9 t80 -105.98 123.17 47.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.772 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -156.99 134.25 10.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.057 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.465 ' OD1' ' O ' ' A' ' 24' ' ' ASN . 29.8 t30 63.33 11.09 5.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.132 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 97.49 -13.19 64.5 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.8 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.77 146.44 24.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.784 0.326 . . . . 0.0 110.708 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 9.9 t-160 -118.21 90.89 3.43 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.264 -179.67 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -80.91 -165.82 0.99 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.822 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.52 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 0.5 OUTLIER -116.59 158.71 23.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.729 179.799 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.681 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.2 mp -51.98 152.54 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.303 -179.791 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.0 m120 55.07 20.49 3.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.162 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.52 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 18.7 tt0 -101.28 152.08 21.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.759 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.421 ' HG2' ' OG1' ' A' ' 46' ' ' THR . 19.9 mt-30 -117.22 145.11 44.11 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.021 -179.836 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' TRP . . . . . 0.603 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 38.2 p90 -146.89 177.56 9.03 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.736 179.771 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -107.78 133.33 52.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.285 -179.631 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.436 ' NE ' ' O ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -132.78 -168.83 2.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.449 179.569 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.582 ' HG1' ' C ' ' A' ' 41' ' ' ASN . 1.1 t -158.48 145.4 17.57 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.886 0.374 . . . . 0.0 111.283 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.538 ' CE1' HD13 ' A' ' 39' ' ' LEU . 41.0 t80 -132.77 132.28 42.08 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.655 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.538 HD13 ' CE1' ' A' ' 38' ' ' TYR . 0.5 OUTLIER 57.4 22.36 7.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.563 -179.727 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 81.88 42.69 8.74 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.859 -0.686 . . . . 0.0 112.558 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.582 ' C ' ' HG1' ' A' ' 37' ' ' THR . 83.9 m-20 -143.6 130.95 20.92 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 120.802 0.334 . . . . 0.0 111.137 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.522 ' O ' ' CD1' ' A' ' 43' ' ' LEU . . . -39.34 156.64 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.838 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.522 ' CD1' ' O ' ' A' ' 42' ' ' ALA . 1.4 tp -169.32 160.07 9.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.217 -179.905 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.496 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.9 t -127.29 128.77 70.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.625 179.624 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.603 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 0.8 OUTLIER -114.69 151.39 33.71 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.148 -179.719 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.421 ' OG1' ' HG2' ' A' ' 33' ' ' GLN . 29.3 m -135.61 133.75 38.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.054 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.524 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 28.4 t -85.7 160.86 19.44 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.813 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.514 ' CB ' ' HB3' ' A' ' 52' ' ' ARG . 75.1 m-85 -133.36 -39.65 0.91 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.943 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.475 ' O ' ' N ' ' A' ' 51' ' ' SER . . . 154.74 45.52 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.5 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 64.52 -69.32 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.44 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' SER . . . . . 0.475 ' N ' ' O ' ' A' ' 49' ' ' GLY . 12.2 m -63.86 -48.06 78.25 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.805 0.336 . . . . 0.0 110.847 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.514 ' HB3' ' CB ' ' A' ' 48' ' ' TYR . 0.2 OUTLIER -56.63 -23.36 40.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.865 179.9 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 53' ' ' GLY . . . . . 0.495 ' O ' ' CD1' ' A' ' 48' ' ' TYR . . . 68.98 145.43 0.16 Allowed Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.594 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.569 ' CE1' ' SG ' ' A' ' 45' ' ' CYS . 13.1 p90 -86.73 170.05 12.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.872 0.368 . . . . 0.0 110.798 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.431 ' O ' ' HA ' ' A' ' 45' ' ' CYS . 39.5 m-20 -141.0 138.28 33.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.728 179.857 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.496 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.5 OUTLIER -117.83 159.97 22.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.105 -179.846 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.454 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.6 pm0 -168.42 172.14 8.55 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.865 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.514 ' HA ' HD12 ' A' ' 43' ' ' LEU . 0.9 OUTLIER -76.5 152.27 36.14 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.872 -179.999 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.953 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.455 -0.221 0 CA-C-O 120.805 0.336 . . . . 0.0 110.483 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.504 ' CB ' HG12 ' A' ' 77' ' ' VAL . 1.6 mp0 -81.24 156.68 25.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.789 179.831 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.459 ' OG1' ' N ' ' A' ' 66' ' ' CYS . 2.6 t 175.37 177.97 0.17 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.996 0.427 . . . . 0.0 111.378 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.459 ' N ' ' OG1' ' A' ' 65' ' ' THR . 0.1 OUTLIER 175.11 -162.34 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.727 -179.989 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.479 ' HA ' ' O ' ' A' ' 73' ' ' ASN . 68.9 t80 -170.07 -38.73 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.045 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 4.6 t70 49.98 88.11 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.757 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.453 ' C ' ' CG ' ' A' ' 70' ' ' TYR . 1.8 mtmt -59.31 159.5 7.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.89 -179.876 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' TYR . . . . . 0.453 ' CG ' ' C ' ' A' ' 69' ' ' LYS . 1.0 OUTLIER 77.68 17.35 1.4 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.008 179.981 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 2.9 m -162.86 -44.93 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.234 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 77.0 75.33 0.92 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.581 -0.818 . . . . 0.0 112.49 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ASN . . . . . 0.479 ' O ' ' HA ' ' A' ' 67' ' ' PHE . 3.0 m120 -129.42 -172.29 2.71 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.88 0.371 . . . . 0.0 110.808 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 1.3 m -146.8 100.85 3.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.022 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.41 ' N ' ' CD1' ' A' ' 75' ' ' TYR . 3.6 m-30 -92.85 -160.54 0.76 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.81 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ARG . . . . . 0.456 ' O ' ' C ' ' A' ' 77' ' ' VAL . 0.4 OUTLIER -142.85 60.51 1.42 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.785 179.825 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.783 ' O ' HG22 ' A' ' 77' ' ' VAL . 6.6 p 29.32 44.71 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.62 179.807 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -160.41 41.55 0.44 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.508 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -160.75 109.06 1.6 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.775 0.321 . . . . 0.0 110.861 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 1.1 t -96.15 172.44 7.98 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.113 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 42.2 p90 -165.54 -174.04 2.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.829 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 -114.77 126.07 54.42 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.832 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 5.0 ttm180 -130.77 90.99 38.45 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.129 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -57.33 120.46 8.39 Favored 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.744 2.296 . . . . 0.0 112.061 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.6 tptp -126.08 146.26 50.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.013 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 60.74 -84.66 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.934 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.1 p -155.81 21.47 0.39 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.017 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 1.8 ttt -144.55 164.71 30.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.881 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.495 ' C ' ' CD1' ' A' ' 90' ' ' TRP . 2.2 mt -99.42 150.99 4.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.139 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 90' ' ' TRP . . . . . 0.584 ' CE3' ' HA ' ' A' ' 106' ' ' ILE . 4.5 m95 -147.08 120.72 9.15 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.867 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -70.82 58.49 0.21 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.985 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' CYS . . . . . 0.418 ' HA ' ' HA ' ' A' ' 104' ' ' CYS . 84.5 m -45.4 136.24 5.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.871 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 40.9 m -122.72 139.25 54.17 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.146 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.42 ' O ' ' HA ' ' A' ' 77' ' ' VAL . 30.8 t -69.95 68.2 0.29 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.848 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.735 HG22 ' CA ' ' A' ' 100' ' ' GLY . 2.6 mt -77.88 123.21 34.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.276 -179.846 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.68 ' O ' ' HB3' ' A' ' 97' ' ' ALA . . . -145.28 -151.52 5.43 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.515 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.68 ' HB3' ' O ' ' A' ' 96' ' ' GLY . . . 85.17 72.49 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.807 0.337 . . . . 0.0 111.136 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 92.04 -59.27 2.77 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.515 -179.883 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.446 ' O ' ' HD2' ' A' ' 101' ' ' ARG . 0.0 OUTLIER -163.82 56.96 0.17 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.865 0.364 . . . . 0.0 110.97 -179.966 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 0.735 ' CA ' HG22 ' A' ' 95' ' ' ILE . . . -80.88 -40.1 12.48 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.435 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.458 ' O ' ' O ' ' A' ' 100' ' ' GLY . 0.0 OUTLIER 55.15 115.89 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.833 0.349 . . . . 0.0 110.863 -179.941 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.586 ' N ' HD13 ' A' ' 102' ' ' ILE . 2.2 mm -44.98 94.36 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.121 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.419 ' N ' ' O ' ' A' ' 101' ' ' ARG . 15.5 t -76.65 149.37 36.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.909 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.418 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 92.5 m -132.75 102.69 5.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.961 -179.946 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 14.8 t -84.81 143.0 29.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.061 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.584 ' HA ' ' CE3' ' A' ' 90' ' ' TRP . 7.3 tt -70.94 140.36 18.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.053 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -103.97 145.54 29.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.115 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -125.18 14.26 8.37 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.955 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 3.1 ttp180 . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.263 -0.875 . . . . 0.0 110.899 -179.95 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo . . . . . 0 C--O 1.232 0.193 0 CA-C-O 120.874 0.281 . . . . 0.0 112.391 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 20' ' ' GLY . . . . . 0.449 ' HA2' HG13 ' A' ' 30' ' ' ILE . . . 67.68 -143.64 42.41 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.526 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -159.68 52.41 0.35 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.861 0.362 . . . . 0.0 110.954 -179.92 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.576 ' CD1' ' HB2' ' A' ' 27' ' ' HIS . 0.4 OUTLIER -47.88 102.78 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.886 -179.987 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -77.95 -167.24 0.95 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.846 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -43.07 -54.86 4.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.886 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -140.98 8.25 2.71 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.472 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.531 ' HB3' ' CE1' ' A' ' 28' ' ' TYR . 0.1 OUTLIER -127.94 131.47 49.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.79 0.328 . . . . 0.0 110.816 179.988 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 27' ' ' HIS . . . . . 0.576 ' HB2' ' CD1' ' A' ' 22' ' ' TYR . 0.7 OUTLIER -117.52 88.67 2.96 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.034 -179.766 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.531 ' CE1' ' HB3' ' A' ' 26' ' ' LYS . 6.9 m-85 -79.68 161.71 25.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.888 179.864 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.532 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 4.0 mt-30 -84.73 137.4 33.24 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.618 179.721 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.668 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.9 mp -37.83 147.28 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 120.904 0.383 . . . . 0.0 111.189 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.471 ' HB2' ' O ' ' A' ' 30' ' ' ILE . 26.5 m-80 67.29 11.89 8.63 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.157 179.76 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.532 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 41.7 tt0 -100.33 144.55 29.2 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.785 0.326 . . . . 0.0 110.771 179.726 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 13.2 mt-30 -111.74 156.63 21.6 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.003 0.43 . . . . 0.0 111.278 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' TRP . . . . . 0.505 ' CZ3' ' HB2' ' A' ' 47' ' ' CYS . 48.3 p90 -163.06 162.67 25.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.641 179.836 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -106.5 124.86 50.23 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.938 0.399 . . . . 0.0 111.1 -179.725 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.485 ' N ' ' O ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -123.52 -169.95 2.03 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.595 179.642 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.3 t -150.26 131.49 14.53 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.161 179.885 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.607 ' HB2' HD22 ' A' ' 43' ' ' LEU . 20.2 t80 -121.77 139.85 53.08 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.506 179.752 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.453 HD13 ' HE1' ' A' ' 38' ' ' TYR . 0.4 OUTLIER 55.88 20.03 3.91 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.943 0.401 . . . . 0.0 110.387 -179.701 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 78.52 46.21 9.02 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.944 -0.646 . . . . 0.0 112.617 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.425 ' O ' ' C ' ' A' ' 42' ' ' ALA . 14.5 m120 -151.32 132.21 14.19 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.808 0.337 . . . . 0.0 110.969 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.425 ' C ' ' O ' ' A' ' 41' ' ' ASN . . . -36.04 147.59 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.982 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.607 HD22 ' HB2' ' A' ' 38' ' ' TYR . 1.8 tp -159.53 147.28 17.2 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.07 -179.842 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.507 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 3.2 t -122.21 131.56 72.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.6 179.7 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.57 ' SG ' ' CD1' ' A' ' 54' ' ' PHE . 0.8 OUTLIER -117.47 152.42 35.07 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.268 -179.678 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.455 ' O ' ' CE1' ' A' ' 48' ' ' TYR . 88.4 m -138.78 112.76 8.53 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.02 179.83 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.505 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 8.7 t -77.05 134.58 38.74 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.947 179.898 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.466 ' O ' ' CG2' ' A' ' 30' ' ' ILE . 2.0 m-85 -106.84 -45.34 4.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.926 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.576 ' CA ' HG23 ' A' ' 30' ' ' ILE . . . 117.89 -172.52 14.42 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.508 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 41.42 -112.11 0.35 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.571 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -110.64 -21.15 12.26 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.799 0.333 . . . . 0.0 111.017 -179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 3.8 mtt180 -47.6 -29.84 3.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.824 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 64.6 -124.67 29.63 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.599 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.57 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 8.1 p90 -155.98 155.04 32.06 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.83 0.348 . . . . 0.0 110.864 -179.817 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -124.43 132.63 53.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.719 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.507 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.1 OUTLIER -112.42 160.96 17.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.114 -179.915 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 178.36 171.93 0.72 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.917 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 79.1 p -59.44 116.16 3.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.931 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.417 ' C ' ' HD3' ' A' ' 59' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.973 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 . . . . . 0 N--CA 1.446 -0.637 0 CA-C-O 120.861 0.363 . . . . 0.0 111.146 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -106.06 79.23 1.38 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.806 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.495 ' OG1' ' N ' ' A' ' 66' ' ' CYS . 0.1 OUTLIER -168.9 174.41 6.46 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.185 -179.948 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.495 ' N ' ' OG1' ' A' ' 65' ' ' THR . 1.6 p 173.93 105.06 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.856 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.401 ' CE1' ' HA2' ' A' ' 72' ' ' GLY . 85.3 t80 -62.36 117.46 6.16 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.91 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ASP . . . . . 0.489 ' HB2' ' O ' ' A' ' 73' ' ' ASN . 6.1 t0 -89.14 78.87 7.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.865 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.417 ' C ' ' O ' ' A' ' 68' ' ' ASP . 9.4 pttp -36.08 -31.55 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.849 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' TYR . . . . . 0.473 ' N ' ' O ' ' A' ' 68' ' ' ASP . 5.2 m-85 -40.79 -56.16 2.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.965 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 12.8 t -126.8 -36.21 2.23 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.166 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' GLY . . . . . 0.401 ' HA2' ' CE1' ' A' ' 67' ' ' PHE . . . 125.11 10.6 4.62 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.53 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ASN . . . . . 0.489 ' O ' ' HB2' ' A' ' 68' ' ' ASP . 20.8 m120 -97.06 140.25 31.85 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.827 0.346 . . . . 0.0 110.848 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 4.1 t -103.92 140.96 36.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.084 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -126.42 -178.62 4.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.797 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -78.48 124.73 28.46 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.87 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.477 HG13 ' N ' ' A' ' 78' ' ' GLY . 8.9 p -46.43 -42.68 5.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.175 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.477 ' N ' HG13 ' A' ' 77' ' ' VAL . . . -86.85 38.34 3.13 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.496 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -123.34 139.52 53.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.814 0.34 . . . . 0.0 110.894 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 24.1 p -111.99 109.32 19.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.093 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' TYR . . . . . 0.415 ' C ' ' OD1' ' A' ' 91' ' ' ASP . 6.4 p90 -121.04 143.34 49.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.834 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.412 ' HA ' ' HA ' ' A' ' 91' ' ' ASP . 50.0 mt-10 -85.15 175.08 9.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.928 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.443 ' HA ' ' HD2' ' A' ' 84' ' ' PRO . 0.0 OUTLIER -164.98 111.12 0.83 Allowed Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.792 179.952 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.443 ' HD2' ' HA ' ' A' ' 83' ' ' ARG . 25.0 Cg_endo -62.2 137.38 65.78 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.718 2.278 . . . . 0.0 112.277 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -171.77 132.41 0.72 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.901 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 54.71 -160.36 0.16 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.911 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.2 p -89.64 33.71 0.84 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.87 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' MET . . . . . 0.506 ' O ' ' NE1' ' A' ' 90' ' ' TRP . 2.6 ttm -162.71 129.54 3.57 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.823 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 1.3 mt -91.67 133.6 32.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.205 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' TRP . . . . . 0.995 ' CZ3' HD11 ' A' ' 106' ' ' ILE . 0.0 OUTLIER -127.5 123.44 35.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.912 179.891 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.415 ' OD1' ' C ' ' A' ' 81' ' ' TYR . 41.8 t0 -76.61 102.02 5.96 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.931 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' CYS . . . . . 0.5 ' HA ' ' HA ' ' A' ' 104' ' ' CYS . 1.1 m -81.21 117.48 21.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.01 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 30.3 m -88.33 127.64 35.48 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.018 179.799 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.404 ' O ' ' HA ' ' A' ' 77' ' ' VAL . 0.1 OUTLIER -68.22 86.2 0.27 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.914 -179.919 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 1.2 mt -99.33 61.58 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.352 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.44 ' O ' ' HB3' ' A' ' 97' ' ' ALA . . . -96.71 -114.27 3.07 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.549 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.44 ' HB3' ' O ' ' A' ' 96' ' ' GLY . . . 68.08 20.75 8.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.95 0.405 . . . . 0.0 111.112 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 156.02 -52.58 0.43 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.722 -0.752 . . . . 0.0 112.327 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.438 ' CG ' ' O ' ' A' ' 99' ' ' ARG . 0.0 OUTLIER -133.12 94.12 3.3 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.826 0.346 . . . . 0.0 110.873 179.993 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -36.72 98.35 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.835 -0.698 . . . . 0.0 112.552 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -117.66 48.95 1.28 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.756 0.313 . . . . 0.0 110.813 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.576 ' H ' HD12 ' A' ' 102' ' ' ILE . 2.2 mp -56.22 102.55 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.192 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 32.5 t -98.6 129.42 45.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.738 179.841 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.5 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 0.7 OUTLIER -99.53 148.41 24.3 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.97 0.414 . . . . 0.0 111.033 -179.888 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -157.05 112.48 2.85 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.061 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.995 HD11 ' CZ3' ' A' ' 90' ' ' TRP . 3.3 mp -40.3 131.95 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.173 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -96.27 108.56 21.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.083 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 3.8 p30 -132.08 36.21 3.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.906 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 9.2 mtp85 . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.945 -179.955 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo . . . . . 0 C--O 1.231 0.163 0 CA-C-O 120.806 0.252 . . . . 0.0 112.275 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 95.4 177.76 37.18 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.384 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 69.6 m -112.58 126.58 55.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.81 0.338 . . . . 0.0 110.877 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 15.0 t80 -119.39 121.47 39.6 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.975 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.423 ' O ' ' C ' ' A' ' 24' ' ' ASN . 2.0 t0 -99.33 -162.5 0.96 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.942 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.423 ' C ' ' O ' ' A' ' 23' ' ' ASP . 7.9 t-20 -35.81 -53.14 0.73 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.954 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -153.64 20.76 0.7 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.588 -179.895 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.42 ' HB3' ' CE2' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -121.41 132.66 54.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.889 0.376 . . . . 0.0 110.952 179.868 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 13.5 t-160 -115.0 91.56 3.65 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.096 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.463 ' HB3' ' OE1' ' A' ' 32' ' ' GLN . 0.1 OUTLIER -83.15 -178.39 7.09 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.929 179.915 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.524 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 1.7 tt0 -114.21 152.41 31.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.548 179.636 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.688 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.4 mp -49.47 154.03 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.153 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 10.7 m-20 59.53 17.95 6.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.02 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.524 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 2.2 tt0 -105.25 142.54 34.84 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.81 179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.428 ' CG ' HG23 ' A' ' 46' ' ' THR . 24.9 mt-30 -115.93 140.71 48.97 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.05 -179.76 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' TRP . . . . . 0.604 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 39.6 p90 -148.5 -173.34 4.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.807 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.671 ' OE2' ' HB1' ' A' ' 42' ' ' ALA . 61.6 tt0 -120.01 121.67 39.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.925 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.844 ' O ' HD22 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -106.81 156.45 18.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.821 179.982 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.3 m -110.09 139.43 45.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.678 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.491 ' N ' HD21 ' A' ' 43' ' ' LEU . 1.0 OUTLIER -155.2 110.65 3.07 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.783 179.827 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 66.56 38.2 4.22 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.613 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 65.31 44.85 92.91 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.446 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.502 ' HB2' HD11 ' A' ' 43' ' ' LEU . 46.4 m-80 -135.78 175.09 9.91 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 120.811 0.338 . . . . 0.0 110.933 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.932 ' C ' HD13 ' A' ' 43' ' ' LEU . . . -117.1 104.15 10.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.905 179.834 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.932 HD13 ' C ' ' A' ' 42' ' ' ALA . 0.0 OUTLIER -114.73 118.92 34.98 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.25 -179.786 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.481 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.7 t -71.13 128.48 34.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.369 179.368 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.604 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 1.9 m -106.17 157.82 17.28 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.148 -179.598 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.443 ' O ' ' CE1' ' A' ' 48' ' ' TYR . 8.6 m -146.63 121.51 9.97 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.083 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.477 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 18.3 t -79.95 134.29 36.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.97 -179.826 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.481 ' HB2' ' HB3' ' A' ' 52' ' ' ARG . 1.4 m-85 -104.95 -45.94 4.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.983 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 114.13 -173.86 15.19 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.423 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 39.81 -129.92 2.54 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.535 179.918 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 18.0 m -102.27 26.13 8.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.767 0.318 . . . . 0.0 110.964 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.481 ' HB3' ' HB2' ' A' ' 48' ' ' TYR . 9.0 mmt180 -87.57 -47.24 8.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.173 -179.846 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 65.3 160.77 0.62 Allowed Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.507 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.573 ' CE1' ' SG ' ' A' ' 45' ' ' CYS . 0.6 OUTLIER -73.99 149.95 41.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.822 0.344 . . . . 0.0 110.835 -179.993 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -112.38 -45.86 3.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.966 -179.846 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.481 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.1 OUTLIER 72.39 146.16 0.08 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.889 -179.966 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.408 ' CG ' ' N ' ' A' ' 58' ' ' SER . 0.9 OUTLIER -124.48 -89.94 0.57 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.933 179.958 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.497 ' HA ' ' HA ' ' A' ' 43' ' ' LEU . 67.4 m -165.45 177.34 7.54 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.713 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.486 ' HB2' ' HB3' ' A' ' 42' ' ' ALA . 0.7 OUTLIER . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.793 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.421 ' HG3' ' N ' ' A' ' 64' ' ' GLU . 1.1 tt0 . . . . . 0 N--CA 1.455 -0.189 0 CA-C-O 120.797 0.332 . . . . 0.0 110.592 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.421 ' N ' ' HG3' ' A' ' 63' ' ' GLU . 16.8 tt0 -127.13 51.18 1.91 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.964 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -165.91 143.64 5.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.114 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 5.1 m -124.59 -172.17 2.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.766 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.565 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 87.8 t80 -161.78 118.59 2.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.067 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ASP . . . . . 0.428 ' O ' ' C ' ' A' ' 69' ' ' LYS . 3.7 t0 -92.22 76.79 5.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.728 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.565 ' HA ' ' CE2' ' A' ' 67' ' ' PHE . 1.3 ptmt -35.18 -35.85 0.05 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.984 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' TYR . . . . . 0.418 ' N ' ' O ' ' A' ' 68' ' ' ASP . 18.6 m-30 -40.29 -57.24 1.79 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.911 179.875 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 20.5 p -140.48 32.33 1.87 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.105 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 46.36 95.45 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.54 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ASN . . . . . 0.477 ' O ' ' HA ' ' A' ' 67' ' ' PHE . 2.0 m-80 -147.18 162.88 37.98 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.792 0.33 . . . . 0.0 110.983 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -132.87 104.59 6.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.154 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.592 ' CD2' ' CE1' ' A' ' 81' ' ' TYR . 0.7 OUTLIER -108.45 13.54 25.38 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.882 -179.926 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ARG . . . . . 0.427 ' O ' ' O ' ' A' ' 75' ' ' TYR . 70.9 mtt85 49.15 178.71 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.767 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.703 ' O ' HG22 ' A' ' 77' ' ' VAL . 12.2 p -95.53 28.17 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.153 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -146.44 14.15 1.61 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.424 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -134.01 127.53 32.49 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.811 0.338 . . . . 0.0 111.02 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.654 HG22 ' CG2' ' A' ' 93' ' ' THR . 22.2 p -92.51 164.16 13.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.118 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' TYR . . . . . 0.592 ' CE1' ' CD2' ' A' ' 75' ' ' TYR . 47.9 p90 -158.55 166.1 32.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.92 -179.927 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -117.18 116.32 27.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.804 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 20.8 mmt-85 -118.23 117.05 35.24 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.946 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -71.96 106.94 2.11 Favored 'Trans proline' 0 C--N 1.342 0.222 0 C-N-CA 122.7 2.267 . . . . 0.0 112.291 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.463 ' O ' ' CB ' ' A' ' 86' ' ' ASP . 1.5 mmpp? -117.61 107.87 14.76 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.876 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.463 ' CB ' ' O ' ' A' ' 85' ' ' LYS . 0.4 OUTLIER 81.85 -153.7 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.801 -179.965 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -81.11 6.95 12.2 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.067 179.904 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 1.4 tpt -137.92 149.22 46.01 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.861 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.53 ' C ' ' CD1' ' A' ' 90' ' ' TRP . 1.4 mt -110.36 154.2 11.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.198 -179.958 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' TRP . . . . . 0.631 ' CD1' ' N ' ' A' ' 90' ' ' TRP . 0.1 OUTLIER -143.23 150.04 38.77 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.776 179.912 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.451 ' OD1' ' HB3' ' A' ' 108' ' ' ASN . 0.2 OUTLIER -83.28 65.38 8.25 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.957 179.979 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 92' ' ' CYS . . . . . 0.41 ' HA ' ' HA ' ' A' ' 104' ' ' CYS . 21.4 m -48.12 137.14 10.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.111 179.928 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.654 ' CG2' HG22 ' A' ' 80' ' ' THR . 18.3 m -145.08 137.52 26.04 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.068 179.878 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.404 ' HB2' ' CD1' ' A' ' 75' ' ' TYR . 5.1 t -74.42 71.82 1.81 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.942 -179.827 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.51 HG22 ' O ' ' A' ' 95' ' ' ILE . 2.3 mt -81.25 66.66 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.296 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.638 ' O ' ' HB3' ' A' ' 97' ' ' ALA . . . 153.1 -83.24 0.16 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.375 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.638 ' HB3' ' O ' ' A' ' 96' ' ' GLY . . . 80.18 80.71 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.803 0.335 . . . . 0.0 111.137 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.54 0.02 86.58 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.589 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 17.9 mtp85 -139.73 -55.53 0.56 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.814 0.34 . . . . 0.0 110.981 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 0.427 ' O ' ' HB3' ' A' ' 101' ' ' ARG . . . -85.61 -103.96 0.7 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.473 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.427 ' HB3' ' O ' ' A' ' 100' ' ' GLY . 0.0 OUTLIER 179.73 169.51 1.15 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.766 0.317 . . . . 0.0 110.895 -179.925 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 3.7 mt -97.1 64.77 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.079 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 19.2 t -45.42 155.95 0.13 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.852 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.41 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 81.1 m -150.97 96.36 2.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.945 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 105' ' ' THR . . . . . 0.441 ' O ' ' N ' ' A' ' 91' ' ' ASP . 0.1 OUTLIER -91.37 150.89 21.08 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.129 -179.965 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.498 HG13 ' CE3' ' A' ' 90' ' ' TRP . 2.3 mp -65.79 144.5 14.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.048 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . 43.64 -163.9 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.086 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' ASN . . . . . 0.464 ' OD1' ' N ' ' A' ' 108' ' ' ASN . 4.7 p-10 -146.95 157.25 43.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.83 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 109' ' ' ARG . . . . . 0.448 ' HG2' ' O ' ' A' ' 108' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.959 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo . . . . . 0 N--CA 1.464 -0.263 0 CA-C-O 120.855 0.273 . . . . 0.0 112.312 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 20' ' ' GLY . . . . . 0.58 ' HA3' ' CE1' ' A' ' 27' ' ' HIS . . . 138.36 -151.72 21.63 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.665 -0.779 . . . . 0.0 112.615 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -158.07 64.83 0.45 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.852 0.358 . . . . 0.0 110.831 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -45.46 137.89 4.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.841 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -162.99 119.82 1.88 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.891 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.404 ' O ' ' CG ' ' A' ' 24' ' ' ASN . 36.6 t30 54.79 30.4 13.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.919 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 85.64 -10.33 65.11 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.539 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.84 128.19 39.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.813 0.34 . . . . 0.0 110.862 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' HIS . . . . . 0.58 ' CE1' ' HA3' ' A' ' 20' ' ' GLY . 34.1 t60 -115.28 94.26 4.65 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.193 -179.706 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -81.71 -168.97 2.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.803 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.531 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 43.1 tt0 -106.01 141.41 37.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.851 179.862 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.694 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.6 mp -48.97 146.14 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.252 -179.859 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.405 ' OD1' HG22 ' A' ' 30' ' ' ILE . 0.6 OUTLIER 67.5 12.64 9.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.901 -179.998 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.531 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 52.6 tt0 -98.65 151.63 20.49 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.637 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 18.9 mt-30 -114.57 152.35 31.92 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.096 -179.836 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' TRP . . . . . 0.56 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 43.4 p90 -153.05 179.08 9.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.78 179.783 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -109.74 127.73 54.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.866 0.365 . . . . 0.0 111.305 -179.662 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.521 ' O ' ' N ' ' A' ' 43' ' ' LEU . 39.5 ttt-85 -133.4 171.67 13.74 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.341 179.631 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.433 ' HG1' ' C ' ' A' ' 41' ' ' ASN . 1.5 t -135.29 139.88 44.71 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.782 0.325 . . . . 0.0 111.352 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.487 ' HB2' HD22 ' A' ' 43' ' ' LEU . 3.6 t80 -126.79 126.61 43.7 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.638 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.456 HD13 ' HA ' ' A' ' 39' ' ' LEU . 2.9 mm? 63.11 25.78 15.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.574 -179.734 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 76.22 43.07 21.97 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 121.041 -0.599 . . . . 0.0 112.667 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.433 ' C ' ' HG1' ' A' ' 37' ' ' THR . 75.9 m-20 -145.56 129.86 17.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.796 0.331 . . . . 0.0 111.074 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.429 ' C ' ' O ' ' A' ' 41' ' ' ASN . . . -37.5 153.98 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.458 179.687 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.521 ' N ' ' O ' ' A' ' 36' ' ' ARG . 4.4 tp -169.52 161.34 9.59 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.082 0.468 . . . . 0.0 111.618 -179.527 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.492 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 19.6 t -124.36 155.88 32.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.232 179.267 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.57 ' SG ' ' CD1' ' A' ' 54' ' ' PHE . 0.5 OUTLIER -139.46 150.46 45.22 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.939 0.4 . . . . 0.0 111.423 -179.618 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 97.9 m -133.89 115.98 15.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.811 179.8 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.507 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 36.9 t -71.73 156.35 39.44 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.971 -179.844 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.524 ' O ' ' CG2' ' A' ' 30' ' ' ILE . 42.3 m-85 -119.25 -53.28 2.25 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.151 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.495 ' HA2' HG23 ' A' ' 30' ' ' ILE . . . 156.82 52.49 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.456 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 48.63 50.21 25.69 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.526 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -149.4 -61.6 0.22 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.832 0.349 . . . . 0.0 110.842 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.524 ' NE ' ' HA ' ' A' ' 52' ' ' ARG . 8.5 mmm180 -68.46 -31.6 71.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.781 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' GLY . . . . . 0.577 ' O ' ' CD2' ' A' ' 54' ' ' PHE . . . 88.02 24.3 35.33 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 120.881 -0.676 . . . . 0.0 112.533 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.577 ' CD2' ' O ' ' A' ' 53' ' ' GLY . 1.5 p90 56.04 151.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.943 0.402 . . . . 0.0 111.106 179.839 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.401 ' O ' ' OD1' ' A' ' 55' ' ' ASN . 43.6 p-10 -130.44 109.38 10.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.64 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.492 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.7 OUTLIER -83.73 170.06 14.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.103 -179.855 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 172.31 166.76 0.11 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.963 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.438 ' HA ' HD12 ' A' ' 43' ' ' LEU . 5.0 t -58.6 154.68 13.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.951 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.835 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.522 ' OE2' ' HB2' ' A' ' 97' ' ' ALA . 0.8 OUTLIER . . . . . 0 CA--C 1.529 0.154 0 CA-C-O 120.765 0.316 . . . . 0.0 110.503 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.515 ' CB ' HG21 ' A' ' 77' ' ' VAL . 0.1 OUTLIER 179.5 -166.38 0.07 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.894 -179.968 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.422 HG23 ' C ' ' A' ' 64' ' ' GLU . 30.5 p -158.02 146.03 18.66 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.215 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.623 ' O ' HG23 ' A' ' 74' ' ' THR . 25.9 p -121.43 -175.81 3.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.788 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.529 ' CE1' ' HA2' ' A' ' 72' ' ' GLY . 76.6 t80 -137.78 127.79 25.77 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.922 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 33.3 t0 -92.1 92.64 8.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.909 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.476 ' HA ' ' CE2' ' A' ' 67' ' ' PHE . 0.8 OUTLIER -47.79 -25.44 1.27 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.005 -179.967 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 70' ' ' TYR . . . . . 0.418 ' C ' ' O ' ' A' ' 69' ' ' LYS . 8.2 m-30 -36.27 -59.37 0.63 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.829 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -159.77 30.51 0.19 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.15 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' GLY . . . . . 0.529 ' HA2' ' CE1' ' A' ' 67' ' ' PHE . . . 71.88 74.48 0.74 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.674 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -138.45 90.83 2.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.723 0.297 . . . . 0.0 110.714 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.623 HG23 ' O ' ' A' ' 66' ' ' CYS . 34.0 m -69.11 137.32 53.34 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.146 -179.97 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.441 ' CD2' ' CE1' ' A' ' 81' ' ' TYR . 66.3 m-85 -126.95 155.55 42.93 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.794 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 11.5 mtp180 -84.22 127.82 34.19 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.917 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.515 HG21 ' CB ' ' A' ' 64' ' ' GLU . 43.0 t -44.72 -27.03 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.108 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -90.08 26.71 9.38 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.589 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -158.39 134.88 9.47 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.826 0.346 . . . . 0.0 111.0 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 5.3 t -111.17 165.28 12.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.905 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' TYR . . . . . 0.441 ' CE1' ' CD2' ' A' ' 75' ' ' TYR . 19.1 p90 -143.73 173.86 11.31 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.892 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -148.46 110.76 4.65 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.773 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.3 143.56 47.63 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.963 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -68.09 139.0 45.31 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.84 2.36 . . . . 0.0 112.29 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.431 ' O ' ' O ' ' A' ' 88' ' ' MET . 0.1 OUTLIER -160.47 133.58 6.63 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.899 179.943 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.404 ' O ' ' OG ' ' A' ' 87' ' ' SER . 0.9 OUTLIER 56.48 52.16 10.31 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.906 179.989 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 87' ' ' SER . . . . . 0.404 ' OG ' ' O ' ' A' ' 86' ' ' ASP . 1.8 p 53.38 23.16 3.17 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.878 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' MET . . . . . 0.431 ' O ' ' O ' ' A' ' 85' ' ' LYS . 0.2 OUTLIER -150.49 143.67 24.88 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.915 179.925 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 4.4 mt -108.5 136.53 43.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.166 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' TRP . . . . . 0.796 ' CZ3' HD11 ' A' ' 106' ' ' ILE . 0.1 OUTLIER -131.18 140.86 49.98 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.74 179.955 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -79.57 52.67 1.44 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.699 179.887 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' CYS . . . . . 0.462 ' HA ' ' HA ' ' A' ' 104' ' ' CYS . 70.9 m -41.43 111.29 0.21 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.087 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.486 ' O ' ' N ' ' A' ' 95' ' ' ILE . 51.9 m -98.34 132.87 43.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.894 179.83 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 43.5 t -65.89 61.98 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.935 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.486 ' N ' ' O ' ' A' ' 93' ' ' THR . 2.5 mt -69.62 105.23 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.205 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.434 ' O ' ' HB3' ' A' ' 97' ' ' ALA . . . -142.56 -119.23 1.43 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.635 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.522 ' HB2' ' OE2' ' A' ' 63' ' ' GLU . . . 67.47 -74.35 0.07 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.831 0.348 . . . . 0.0 110.981 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -128.64 80.41 0.36 Allowed Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.827 -0.702 . . . . 0.0 112.318 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 2.2 mtt-85 62.75 13.35 6.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.811 0.339 . . . . 0.0 110.675 -179.795 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 0.485 ' CA ' HG22 ' A' ' 95' ' ' ILE . . . -43.72 -52.09 6.66 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.601 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.449 ' HB3' ' O ' ' A' ' 100' ' ' GLY . 0.0 OUTLIER 68.39 112.44 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.806 0.336 . . . . 0.0 110.73 -179.945 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.43 ' C ' ' O ' ' A' ' 101' ' ' ARG . 2.3 mp -34.95 151.53 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.224 -179.883 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 4.7 t -146.04 128.91 16.36 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.831 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.462 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 70.9 m -111.66 138.29 48.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.096 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -144.46 140.73 29.12 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.891 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.796 HD11 ' CZ3' ' A' ' 90' ' ' TRP . 2.8 mp -82.0 114.16 22.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.106 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -113.48 143.82 43.87 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.165 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 7.0 p-10 -123.61 115.57 21.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.949 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.248 0.992 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.88 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo . . . . . 0 N--CA 1.465 -0.193 0 CA-C-O 120.827 0.261 . . . . 0.0 112.206 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 20' ' ' GLY . . . . . 0.417 ' C ' ' SG ' ' A' ' 21' ' ' CYS . . . 160.99 -153.26 24.06 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.482 -179.833 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.417 ' SG ' ' C ' ' A' ' 20' ' ' GLY . 0.0 OUTLIER -159.82 93.0 1.06 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.844 0.354 . . . . 0.0 110.828 179.985 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.468 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 6.5 t80 -96.26 101.34 12.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.96 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.494 ' OD2' ' CE2' ' A' ' 54' ' ' PHE . 9.5 t70 -128.4 133.72 48.66 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.858 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 45.6 t30 51.66 28.44 4.77 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.015 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 86.61 -2.22 87.28 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.519 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.592 ' HB3' ' CZ ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -95.7 137.84 34.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.831 0.348 . . . . 0.0 110.95 179.913 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 -114.37 85.76 2.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.906 -179.794 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.592 ' CZ ' ' HB3' ' A' ' 26' ' ' LYS . 2.3 m-85 -79.64 176.48 9.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.961 -179.922 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.513 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 1.2 tt0 -104.09 136.91 42.84 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.56 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.67 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.8 mp -40.76 146.85 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.33 -179.877 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.461 ' HB2' ' O ' ' A' ' 30' ' ' ILE . 30.9 m120 67.9 10.68 7.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.303 179.71 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.513 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 59.9 tt0 -94.62 149.29 21.39 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.806 0.336 . . . . 0.0 110.828 179.79 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.424 ' CG ' HG23 ' A' ' 46' ' ' THR . 19.2 mt-30 -113.38 147.19 38.2 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.209 -179.744 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' TRP . . . . . 0.519 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 42.6 p90 -157.27 -164.45 1.59 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.494 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.64 ' OE1' ' HB1' ' A' ' 42' ' ' ALA . 1.4 tm-20 -128.89 122.73 30.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.86 0.362 . . . . 0.0 111.191 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.666 ' O ' HD22 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -114.92 131.19 56.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.546 179.751 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.4 m -99.83 129.41 45.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.681 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.474 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 1.5 t80 -145.14 112.59 6.18 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.854 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.474 ' HB2' ' O ' ' A' ' 38' ' ' TYR . 0.3 OUTLIER 77.74 56.97 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.658 -179.924 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 48.91 28.94 7.77 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.357 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 34.7 m-80 -140.45 138.85 35.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.795 0.331 . . . . 0.0 110.995 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 1.029 ' C ' HD13 ' A' ' 43' ' ' LEU . . . -87.81 126.43 35.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.169 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 1.029 HD13 ' C ' ' A' ' 42' ' ' ALA . 0.0 OUTLIER -124.34 123.03 39.31 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.306 -0.407 . . . . 0.0 111.175 -179.965 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.48 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.7 t -67.15 133.24 31.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.337 -0.392 . . . . 0.0 109.972 179.17 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.571 ' SG ' ' CD1' ' A' ' 54' ' ' PHE . 1.6 m -115.0 167.35 10.88 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.05 0.452 . . . . 0.0 111.76 -179.037 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.497 ' O ' ' CE1' ' A' ' 48' ' ' TYR . 7.2 m -157.96 118.34 3.39 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.773 -0.648 . . . . 0.0 110.697 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.493 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 12.4 t -78.27 136.05 37.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.207 -179.584 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.501 ' HB2' ' HB2' ' A' ' 52' ' ' ARG . 5.4 m-85 -111.07 -32.29 6.84 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.908 179.848 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 76.6 -170.82 54.98 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.486 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLY . . . . . 0.526 ' O ' ' CB ' ' A' ' 51' ' ' SER . . . 54.4 25.46 34.08 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.522 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' SER . . . . . 0.526 ' CB ' ' O ' ' A' ' 50' ' ' GLY . 3.2 m 85.06 -13.29 0.67 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.835 0.35 . . . . 0.0 111.157 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.501 ' HB2' ' HB2' ' A' ' 48' ' ' TYR . 60.7 mtt180 -57.58 -28.85 63.97 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.929 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 58.74 168.65 0.2 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.454 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.571 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 7.6 p90 -84.11 146.66 27.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.765 0.316 . . . . 0.0 110.815 -179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -101.95 -47.82 4.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.018 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.49 ' HA ' ' HA ' ' A' ' 45' ' ' CYS . 0.1 OUTLIER 71.31 159.42 0.21 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.813 -179.881 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.4 ' CG ' ' N ' ' A' ' 58' ' ' SER . 1.5 tp10 -141.65 -93.5 0.14 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.15 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.506 ' HA ' ' HA ' ' A' ' 43' ' ' LEU . 21.7 m -171.63 160.96 5.98 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.88 0.371 . . . . 0.0 111.02 -179.767 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 11.7 tmtt? . . . . . 0 C--N 1.328 -0.339 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.804 179.907 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.447 ' HG3' ' N ' ' A' ' 64' ' ' GLU . 1.9 tt0 . . . . . 0 N--CA 1.455 -0.221 0 CA-C-O 120.919 0.39 . . . . 0.0 110.544 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.447 ' N ' ' HG3' ' A' ' 63' ' ' GLU . 13.6 tt0 -169.46 46.07 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.933 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.622 HG22 ' CG2' ' A' ' 74' ' ' THR . 0.0 OUTLIER -142.15 166.5 24.54 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.211 179.907 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.521 ' HA ' ' CA ' ' A' ' 98' ' ' GLY . 3.8 m -149.95 -176.03 5.28 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.917 -179.846 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.577 ' CE2' ' HA2' ' A' ' 72' ' ' GLY . 27.8 t80 -178.61 93.62 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.887 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ASP . . . . . 0.468 ' O ' ' O ' ' A' ' 69' ' ' LYS . 13.6 t70 -93.98 38.18 1.08 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.928 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.471 ' HA ' ' CE1' ' A' ' 67' ' ' PHE . 1.3 pttt 36.6 -159.73 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.953 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' TYR . . . . . 0.458 ' HB2' ' O ' ' A' ' 69' ' ' LYS . 21.9 m-85 73.32 -54.71 0.69 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.964 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 13.2 p -135.14 12.97 3.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.027 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' GLY . . . . . 0.577 ' HA2' ' CE2' ' A' ' 67' ' ' PHE . . . 46.43 24.63 1.72 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.564 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ASN . . . . . 0.463 ' HB3' ' CE1' ' A' ' 75' ' ' TYR . 1.1 t-20 -72.21 109.6 6.07 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.758 0.314 . . . . 0.0 110.929 -179.933 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.622 ' CG2' HG22 ' A' ' 65' ' ' THR . 92.3 m -78.48 112.11 15.2 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.015 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.659 ' CE2' ' CE2' ' A' ' 81' ' ' TYR . 9.1 m-85 -94.37 -175.77 3.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.898 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ARG . . . . . 0.447 ' HD2' ' HA ' ' A' ' 76' ' ' ARG . 0.2 OUTLIER -104.61 126.46 51.72 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.819 179.991 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.596 HG23 ' N ' ' A' ' 65' ' ' THR . 31.9 t -62.62 -14.94 14.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.213 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -102.39 16.2 55.4 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.475 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -155.69 163.74 39.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.812 0.339 . . . . 0.0 110.922 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.462 HG22 HG23 ' A' ' 93' ' ' THR . 30.6 p -95.99 167.39 11.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.217 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' TYR . . . . . 0.659 ' CE2' ' CE2' ' A' ' 75' ' ' TYR . 15.6 p90 -146.2 131.68 18.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.858 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.608 ' OE2' HG22 ' A' ' 89' ' ' ILE . 0.8 OUTLIER -70.96 113.32 7.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.02 -179.951 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.511 ' NE ' ' HA ' ' A' ' 83' ' ' ARG . 0.7 OUTLIER -120.71 81.22 32.88 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.768 179.822 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_exo -44.58 116.6 1.15 Allowed 'Trans proline' 0 N--CA 1.465 -0.173 0 C-N-CA 122.877 2.385 . . . . 0.0 112.433 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -132.66 122.11 24.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.897 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 3.7 t0 72.84 -156.53 0.08 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.84 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.17 8.04 12.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.952 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -128.64 160.32 32.8 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.915 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.948 ' O ' HG23 ' A' ' 106' ' ' ILE . 2.6 mp -107.81 128.18 63.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.027 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 90' ' ' TRP . . . . . 0.696 ' CZ3' HD11 ' A' ' 106' ' ' ILE . 1.0 OUTLIER -122.21 136.5 54.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.981 -179.987 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -93.15 57.81 2.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.803 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' CYS . . . . . 0.474 ' HA ' ' HA ' ' A' ' 104' ' ' CYS . 0.7 OUTLIER -38.21 151.63 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.095 -179.94 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.462 HG23 HG22 ' A' ' 80' ' ' THR . 88.7 m -128.2 128.71 45.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.977 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.436 ' HB3' ' HA ' ' A' ' 77' ' ' VAL . 16.2 t -64.66 88.3 0.06 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.01 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.429 ' HB ' ' O ' ' A' ' 101' ' ' ARG . 0.8 OUTLIER -101.8 46.62 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.168 179.998 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 172.64 -159.6 30.37 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.476 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -90.98 63.65 5.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.836 0.351 . . . . 0.0 111.044 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' GLY . . . . . 0.521 ' CA ' ' HA ' ' A' ' 66' ' ' CYS . . . 68.12 10.36 59.15 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.489 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 171.59 51.32 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.838 0.351 . . . . 0.0 110.945 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -111.88 -62.13 0.46 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.371 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.429 ' O ' ' HB ' ' A' ' 95' ' ' ILE . 0.4 OUTLIER -141.45 38.89 1.71 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.95 0.405 . . . . 0.0 110.827 179.808 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.455 HG21 ' OH ' ' A' ' 81' ' ' TYR . 2.7 mt -56.96 89.25 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.168 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.41 ' O ' ' HA ' ' A' ' 92' ' ' CYS . 27.0 t -84.71 138.72 32.48 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.791 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.474 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 0.5 OUTLIER -110.93 141.63 44.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.982 -179.931 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 1.5 t -156.89 121.55 4.48 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.054 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.948 HG23 ' O ' ' A' ' 89' ' ' ILE . 1.7 mp -66.48 138.84 22.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.086 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -64.65 106.2 1.13 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.167 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -105.61 111.68 24.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.876 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.252 -0.88 . . . . 0.0 110.971 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo . . . . . 0 C--O 1.232 0.223 0 CA-C-O 120.963 0.318 . . . . 0.0 112.391 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 73.11 -154.44 49.53 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.873 -0.679 . . . . 0.0 112.455 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 85.0 m -138.99 135.16 34.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.837 0.351 . . . . 0.0 110.922 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 47.7 t80 -110.3 119.84 40.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.877 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -167.73 151.61 6.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.916 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.455 ' HB3' ' OH ' ' A' ' 28' ' ' TYR . 28.8 t-20 55.35 51.03 13.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.908 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 47.56 23.26 2.07 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.482 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.554 ' HB3' ' CE2' ' A' ' 28' ' ' TYR . 0.1 OUTLIER -132.29 139.12 48.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.842 0.353 . . . . 0.0 110.865 -179.977 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -109.23 85.9 2.19 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.947 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.554 ' CE2' ' HB3' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -79.84 165.15 23.0 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.815 179.948 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.523 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 0.0 OUTLIER -100.25 162.33 13.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.741 179.806 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.681 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.5 mp -49.53 156.23 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.351 -179.868 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.43 ' N ' HG22 ' A' ' 30' ' ' ILE . 1.7 m-80 56.86 19.65 4.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.066 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.523 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 10.1 tt0 -101.29 147.69 26.0 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.825 0.345 . . . . 0.0 110.91 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 14.2 mt-30 -116.75 145.46 43.47 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.016 -179.855 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' TRP . . . . . 0.6 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 42.0 p90 -150.35 168.88 22.79 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.785 179.862 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 76.2 tt0 -101.15 126.53 47.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.171 -179.741 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.471 ' HB2' ' SG ' ' A' ' 56' ' ' CYS . 1.5 mtp180 -119.4 176.95 5.1 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.674 179.847 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -144.61 132.46 21.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.701 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.524 ' HB2' HD22 ' A' ' 43' ' ' LEU . 0.6 OUTLIER -154.76 143.59 20.84 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.678 179.671 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.463 ' HB2' ' O ' ' A' ' 38' ' ' TYR . 3.4 mm? 66.76 22.51 10.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.484 -179.678 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 69.69 38.85 77.74 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.531 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -152.08 153.3 33.66 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-O 120.708 0.29 . . . . 0.0 110.984 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.88 ' O ' HD12 ' A' ' 43' ' ' LEU . . . -60.75 146.58 45.44 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.946 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.88 HD12 ' O ' ' A' ' 42' ' ' ALA . 4.3 mp -142.18 161.5 37.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.929 0.395 . . . . 0.0 111.364 -179.674 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.499 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.2 t -128.9 123.65 59.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.244 179.353 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.6 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 1.3 m -109.8 158.76 17.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.618 -179.263 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 24.7 m -146.38 119.53 8.86 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.797 179.644 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.544 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 28.7 t -74.16 143.69 45.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.158 -179.795 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.461 ' N ' ' O ' ' A' ' 53' ' ' GLY . 26.2 m-85 -119.4 -24.66 6.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.948 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 123.87 -169.07 15.98 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.453 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLY . . . . . 0.516 ' O ' ' CB ' ' A' ' 51' ' ' SER . . . -75.17 85.94 0.8 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.601 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' SER . . . . . 0.516 ' CB ' ' O ' ' A' ' 50' ' ' GLY . 0.3 OUTLIER 160.0 -62.91 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.823 0.344 . . . . 0.0 110.849 179.976 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -85.07 -29.94 24.49 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.024 -179.897 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' GLY . . . . . 0.461 ' O ' ' N ' ' A' ' 48' ' ' TYR . . . 70.34 -111.51 3.82 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.522 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.566 ' CE1' ' SG ' ' A' ' 45' ' ' CYS . 1.8 p90 -153.65 154.21 33.74 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.893 0.378 . . . . 0.0 110.886 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -133.2 93.96 3.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.622 179.777 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.499 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.4 OUTLIER -68.0 166.79 15.13 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.146 -179.673 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.491 ' HG2' ' N ' ' A' ' 58' ' ' SER . 14.6 tt0 -152.75 -89.69 0.05 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.131 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.491 ' N ' ' HG2' ' A' ' 57' ' ' GLU . 0.1 OUTLIER -164.49 -167.18 1.22 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.976 179.953 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.972 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.649 ' O ' ' HB2' ' A' ' 97' ' ' ALA . 2.8 tt0 . . . . . 0 N--CA 1.456 -0.16 0 CA-C-O 120.903 0.383 . . . . 0.0 110.452 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -66.57 -169.02 0.07 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.826 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 7.2 p 48.01 -177.56 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.18 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.42 ' SG ' ' HB2' ' A' ' 75' ' ' TYR . 18.5 p -150.12 -156.33 0.71 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.791 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.465 ' O ' ' N ' ' A' ' 69' ' ' LYS . 12.6 t80 -168.32 81.77 0.17 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.891 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -52.74 87.08 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.872 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.465 ' N ' ' O ' ' A' ' 67' ' ' PHE . 2.0 pttt -52.67 -29.84 28.68 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.862 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' TYR . . . . . 0.403 ' C ' ' O ' ' A' ' 69' ' ' LYS . 8.3 m-30 -38.4 -56.49 1.24 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.903 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -122.58 -8.08 8.55 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.09 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 80.12 69.67 1.38 Allowed Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.511 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 12.8 m120 -122.37 -162.88 1.03 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.942 0.401 . . . . 0.0 110.965 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 18.0 m -144.39 105.21 4.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.976 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.42 ' HB2' ' SG ' ' A' ' 66' ' ' CYS . 19.3 m-85 -120.68 160.38 23.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.747 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -91.58 146.56 23.69 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.797 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 93.7 t -45.59 -37.74 2.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.096 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -95.39 14.8 64.46 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.515 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -107.52 100.69 10.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.922 0.391 . . . . 0.0 110.996 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.876 HG22 HG23 ' A' ' 93' ' ' THR . 64.6 p -73.98 143.6 45.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.205 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' TYR . . . . . 0.743 ' OH ' HG21 ' A' ' 102' ' ' ILE . 42.2 p90 -133.88 109.98 9.42 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.784 179.842 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -50.4 168.24 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.083 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -167.66 86.58 0.75 Allowed Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.801 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo -69.13 91.94 0.45 Allowed 'Trans proline' 0 C--O 1.232 0.195 0 C-N-CA 122.734 2.289 . . . . 0.0 112.402 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 2.8 mttt -128.26 132.54 48.72 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.788 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 4.8 t0 74.95 10.23 3.85 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.884 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 66.3 30.4 9.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.852 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' MET . . . . . 0.433 ' HG3' HG12 ' A' ' 106' ' ' ILE . 2.3 tpt -120.45 -29.91 4.67 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.919 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.448 ' C ' ' CD1' ' A' ' 90' ' ' TRP . 84.4 mt 58.77 129.02 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.057 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' TRP . . . . . 0.758 ' CH2' HD11 ' A' ' 106' ' ' ILE . 0.7 OUTLIER -136.15 132.49 36.07 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.852 -179.992 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.468 ' N ' ' O ' ' A' ' 105' ' ' THR . 0.5 OUTLIER -70.77 62.22 0.27 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.865 -179.972 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 64.2 m -51.48 136.74 25.39 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.998 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.876 HG23 HG22 ' A' ' 80' ' ' THR . 0.2 OUTLIER -126.84 124.83 40.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.912 179.872 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.52 ' HA ' HG23 ' A' ' 102' ' ' ILE . 0.5 OUTLIER -60.37 73.14 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.938 -179.897 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.517 ' N ' ' O ' ' A' ' 93' ' ' THR . 1.9 mt -88.89 58.81 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.238 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 174.24 161.85 24.91 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.481 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.649 ' HB2' ' O ' ' A' ' 63' ' ' GLU . . . -107.71 53.32 0.69 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.817 0.341 . . . . 0.0 110.961 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 95.75 -3.39 65.21 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.523 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.446 ' CG ' ' O ' ' A' ' 99' ' ' ARG . 1.9 ttm180 -173.23 40.83 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.859 0.361 . . . . 0.0 110.94 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 0.445 ' O ' ' HB3' ' A' ' 101' ' ' ARG . . . -94.82 -79.85 1.47 Allowed Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.43 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.445 ' HB3' ' O ' ' A' ' 100' ' ' GLY . 0.0 OUTLIER 171.33 51.33 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.758 0.313 . . . . 0.0 110.9 179.992 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.743 HG21 ' OH ' ' A' ' 81' ' ' TYR . 3.5 mm -37.11 97.88 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.143 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.402 ' N ' ' O ' ' A' ' 101' ' ' ARG . 3.4 t -71.92 157.49 37.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.948 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 89.5 m -150.03 114.37 5.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.924 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' THR . . . . . 0.468 ' O ' ' N ' ' A' ' 91' ' ' ASP . 8.8 t -129.63 154.27 47.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.19 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.758 HD11 ' CH2' ' A' ' 90' ' ' TRP . 2.9 mt -87.72 125.23 41.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.019 179.828 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -173.53 117.69 0.27 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.124 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -128.89 165.84 20.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.926 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 12.1 ttp180 . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.204 -0.903 . . . . 0.0 110.927 179.928 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.468 ' HB2' HD11 ' A' ' 30' ' ' ILE . 73.9 Cg_endo . . . . . 0 N--CA 1.463 -0.318 0 CA-C-O 120.739 0.224 . . . . 0.0 112.4 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 114.37 162.91 14.41 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.499 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 86.9 m -116.54 115.26 25.43 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.808 0.337 . . . . 0.0 110.863 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -91.26 114.35 26.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.951 -179.955 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -154.59 156.05 35.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.963 -179.906 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 46.1 t30 52.36 27.11 4.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.955 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 76.07 1.02 67.05 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.545 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 2.5 mptt -110.96 148.59 32.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.831 0.348 . . . . 0.0 110.939 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 4.5 t-160 -117.15 88.81 2.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.863 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -79.64 -175.19 4.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.96 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.506 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 10.6 tt0 -105.92 156.55 18.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.895 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.687 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.3 mp -52.8 156.59 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.34 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.422 ' N ' HG22 ' A' ' 30' ' ' ILE . 0.7 OUTLIER 59.42 14.22 3.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.981 179.866 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.506 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 21.1 tt0 -96.06 155.09 16.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.933 179.938 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 40.4 mt-30 -122.87 134.65 54.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.981 -179.884 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' TRP . . . . . 0.586 ' CZ2' ' HB3' ' A' ' 45' ' ' CYS . 23.4 p90 -136.01 175.07 9.93 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.964 179.827 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -100.37 127.6 46.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.036 -179.906 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.522 ' O ' ' CB ' ' A' ' 43' ' ' LEU . 17.5 tpt85 -128.31 162.75 26.33 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.643 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -140.54 129.96 23.93 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.562 -179.813 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.467 ' CD1' ' HB2' ' A' ' 39' ' ' LEU . 12.3 t80 -127.73 119.25 25.38 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.914 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.467 ' HB2' ' CD1' ' A' ' 38' ' ' TYR . 3.4 tp 76.26 13.29 2.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.722 -179.824 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 84.66 39.45 8.83 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.7 180.0 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.42 ' O ' ' C ' ' A' ' 42' ' ' ALA . 7.5 m-80 -141.67 125.52 17.06 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.734 0.302 . . . . 0.0 110.846 179.866 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.503 ' O ' HD12 ' A' ' 43' ' ' LEU . . . -35.55 147.77 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.946 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.522 ' CB ' ' O ' ' A' ' 36' ' ' ARG . 1.1 tp -159.28 150.7 20.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.224 -179.608 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.485 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 3.1 t -122.37 135.48 62.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.358 179.541 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.586 ' HB3' ' CZ2' ' A' ' 34' ' ' TRP . 0.7 OUTLIER -118.69 157.13 28.05 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.396 -179.429 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.434 ' O ' ' CE1' ' A' ' 48' ' ' TYR . 76.1 m -140.44 116.17 10.24 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.97 179.799 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.544 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 19.4 t -75.59 132.38 40.61 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.979 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.434 ' CE1' ' O ' ' A' ' 46' ' ' THR . 7.3 m-85 -105.52 -26.04 12.06 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.749 179.883 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.446 ' N ' HG23 ' A' ' 30' ' ' ILE . . . 87.02 163.24 38.63 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.551 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 58.79 -129.99 50.4 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.529 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -96.48 -13.06 23.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.848 0.356 . . . . 0.0 110.849 -179.918 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.409 ' HB3' ' CB ' ' A' ' 48' ' ' TYR . 0.4 OUTLIER -50.41 -33.49 20.95 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.96 -179.941 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 63.72 161.02 0.35 Allowed Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.785 -0.722 . . . . 0.0 112.537 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.574 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 4.0 p90 -91.45 161.36 15.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.859 0.361 . . . . 0.0 110.851 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -139.9 120.69 14.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.871 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.485 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.8 OUTLIER -90.95 168.2 11.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.938 -179.911 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -176.23 -178.23 0.96 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.978 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 17.3 m -80.09 160.01 25.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.91 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 3.1 mttt . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.804 179.915 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.447 -0.591 0 CA-C-O 120.823 0.344 . . . . 0.0 111.129 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.412 ' O ' ' O ' ' A' ' 65' ' ' THR . 0.1 OUTLIER -68.05 -166.89 0.07 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.911 179.959 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.412 ' O ' ' O ' ' A' ' 64' ' ' GLU . 6.2 p 46.45 -175.34 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.014 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.488 ' O ' HG23 ' A' ' 74' ' ' THR . 0.5 OUTLIER -160.91 -175.17 4.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.108 -179.877 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -130.08 143.54 50.85 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.836 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ASP . . . . . 0.511 ' O ' ' N ' ' A' ' 72' ' ' GLY . 0.5 OUTLIER -117.3 81.75 1.7 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.914 -179.925 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 28.2 pttt -44.64 -33.54 1.85 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.834 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 4.1 m-30 -44.44 -61.3 1.58 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.809 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -134.03 27.31 3.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.978 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' GLY . . . . . 0.511 ' N ' ' O ' ' A' ' 68' ' ' ASP . . . 46.51 81.86 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.484 179.926 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ASN . . . . . 0.568 ' HB3' ' CZ ' ' A' ' 75' ' ' TYR . 2.5 m120 -148.18 111.86 5.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.824 0.345 . . . . 0.0 110.961 -179.922 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.488 HG23 ' O ' ' A' ' 66' ' ' CYS . 18.7 m -80.21 125.97 30.52 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.954 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.568 ' CZ ' ' HB3' ' A' ' 73' ' ' ASN . 78.2 m-85 -121.26 175.78 5.96 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.634 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' ARG . . . . . 0.427 ' HB2' ' HB2' ' A' ' 79' ' ' ASP . 22.1 mtm180 -92.1 154.63 18.6 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.887 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.403 HG22 ' HA ' ' A' ' 97' ' ' ALA . 89.9 t -57.35 -63.32 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.127 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -83.4 51.59 4.6 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.474 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ASP . . . . . 0.427 ' HB2' ' HB2' ' A' ' 76' ' ' ARG . 10.7 t0 -147.55 125.11 11.72 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.779 0.323 . . . . 0.0 110.92 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 44.6 p -86.23 150.24 24.52 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.068 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' TYR . . . . . 0.485 ' OH ' HG21 ' A' ' 102' ' ' ILE . 47.2 p90 -148.97 114.54 5.61 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.977 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.483 ' HG3' ' OD1' ' A' ' 91' ' ' ASP . 18.6 mt-10 -65.77 141.56 58.27 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.845 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.21 86.37 31.06 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.798 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 77.7 Cg_exo -49.93 96.8 0.03 OUTLIER 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.723 2.282 . . . . 0.0 112.354 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -121.33 136.5 54.96 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.984 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 53.2 -155.37 0.2 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.946 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 7.7 t -89.2 43.96 1.18 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.996 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' MET . . . . . 0.555 ' O ' ' CD1' ' A' ' 90' ' ' TRP . 2.9 ttm -175.67 126.16 0.23 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.952 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 9.1 mt -87.03 128.71 39.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.037 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' TRP . . . . . 0.575 ' CZ3' HD11 ' A' ' 106' ' ' ILE . 1.2 m95 -119.92 120.45 36.42 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.912 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.483 ' OD1' ' HG3' ' A' ' 82' ' ' GLU . 0.2 OUTLIER -60.58 87.85 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.844 179.94 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 25.4 m -67.77 123.36 20.3 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.985 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.41 ' O ' ' HA ' ' A' ' 102' ' ' ILE . 82.5 m -112.23 136.45 51.63 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.914 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 44.2 t -70.08 62.58 0.21 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.053 -179.727 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.488 ' HB ' ' O ' ' A' ' 101' ' ' ARG . 2.7 mt -71.4 96.48 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.087 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.52 ' O ' ' N ' ' A' ' 98' ' ' GLY . . . 123.85 103.98 1.61 Allowed Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.363 -179.924 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.403 ' HA ' HG22 ' A' ' 77' ' ' VAL . . . -49.29 85.28 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.795 0.331 . . . . 0.0 111.356 -179.741 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 98' ' ' GLY . . . . . 0.52 ' N ' ' O ' ' A' ' 96' ' ' GLY . . . 119.24 10.98 7.7 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.603 -0.808 . . . . 0.0 113.004 179.693 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.498 ' HB3' ' O ' ' A' ' 98' ' ' GLY . 0.1 OUTLIER 83.29 107.91 0.06 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.922 0.392 . . . . 0.0 110.838 -179.982 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 0.471 ' O ' ' HG3' ' A' ' 101' ' ' ARG . . . -150.11 -38.46 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.393 179.86 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.488 ' O ' ' HB ' ' A' ' 95' ' ' ILE . 0.7 OUTLIER -146.02 38.58 1.09 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.71 0.291 . . . . 0.0 111.041 179.913 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.485 HG21 ' OH ' ' A' ' 81' ' ' TYR . 17.6 mt -47.59 90.69 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.18 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.462 ' N ' ' O ' ' A' ' 101' ' ' ARG . 0.2 OUTLIER -87.24 149.33 24.66 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.916 179.926 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 3.6 m -134.6 109.22 8.51 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.921 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -106.27 143.2 34.74 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.088 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.575 HD11 ' CZ3' ' A' ' 90' ' ' TRP . 2.5 mp -66.48 94.34 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.117 179.938 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -128.32 113.13 15.23 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.152 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' ASN . . . . . 0.405 ' O ' ' HB3' ' A' ' 109' ' ' ARG . 21.9 t-20 -175.4 68.16 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.958 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 109' ' ' ARG . . . . . 0.405 ' HB3' ' O ' ' A' ' 108' ' ' ASN . 4.6 ptp180 . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.899 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo . . . . . 0 C--O 1.231 0.159 0 CA-C-O 120.778 0.241 . . . . 0.0 112.274 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 142.21 -171.88 24.43 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.55 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -159.99 110.42 1.88 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.817 0.341 . . . . 0.0 110.92 -179.94 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -90.05 140.49 29.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.916 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.451 ' OD1' ' O ' ' A' ' 26' ' ' LYS . 1.1 p-10 -126.98 -160.95 1.03 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.848 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.432 ' C ' ' O ' ' A' ' 23' ' ' ASP . 0.7 OUTLIER -34.87 -52.25 0.53 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.009 -0.542 . . . . 0.0 111.068 -179.882 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -163.5 22.81 0.18 Allowed Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.62 180.0 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.53 ' CE ' ' HA ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -128.95 144.82 51.3 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.798 0.332 . . . . 0.0 110.969 179.797 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 4.2 t-160 -119.66 85.42 2.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.302 -179.708 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.526 ' CE2' ' CG ' ' A' ' 34' ' ' TRP . 96.6 m-85 -85.01 166.3 16.83 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.833 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.514 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 0.0 OUTLIER -91.86 149.4 21.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.608 179.705 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.66 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.8 mp -41.58 147.14 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 120.851 0.357 . . . . 0.0 111.191 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.476 ' HB2' ' O ' ' A' ' 30' ' ' ILE . 70.4 m-20 67.17 11.47 8.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.301 179.813 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.514 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 10.2 tp60 -99.24 145.06 27.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.799 0.333 . . . . 0.0 110.613 179.66 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -112.63 156.51 22.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.173 -179.714 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' TRP . . . . . 0.571 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 48.9 p90 -160.87 173.99 14.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.887 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.455 ' HG3' ' O ' ' A' ' 43' ' ' LEU . 0.1 OUTLIER -99.92 141.78 32.29 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.113 -179.823 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.52 ' O ' ' N ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -140.36 169.81 16.98 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.724 179.886 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -137.45 125.76 23.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.769 -179.762 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.42 ' HB2' HD22 ' A' ' 43' ' ' LEU . 6.1 t80 -119.6 136.84 54.2 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.681 179.718 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.516 ' HA ' HD12 ' A' ' 39' ' ' LEU . 2.4 tp 64.24 13.1 7.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.693 -179.77 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 85.71 29.65 26.03 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.933 -0.651 . . . . 0.0 112.743 179.847 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -133.39 145.67 50.54 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.784 0.326 . . . . 0.0 111.027 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -43.75 151.29 0.21 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.64 179.768 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.52 ' N ' ' O ' ' A' ' 36' ' ' ARG . 4.4 tp -170.24 165.59 8.96 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.951 0.405 . . . . 0.0 111.379 -179.615 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.494 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 17.7 t -132.31 151.97 35.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.398 179.459 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.571 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 0.5 OUTLIER -129.26 153.56 47.67 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.903 0.382 . . . . 0.0 111.423 -179.564 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 69.4 m -138.4 131.96 30.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.757 179.715 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.498 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 21.0 t -92.86 161.5 14.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.042 -179.728 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.516 ' O ' ' CG2' ' A' ' 30' ' ' ILE . 36.8 m-85 -138.62 -43.99 0.49 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.771 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 104.2 167.67 24.89 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.469 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 65.95 -113.38 5.7 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.613 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -104.29 -24.65 13.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.783 0.325 . . . . 0.0 110.992 -179.875 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.483 ' HB3' ' HB2' ' A' ' 48' ' ' TYR . 0.1 OUTLIER -54.99 -36.33 65.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.847 -179.952 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 63.48 -103.89 0.75 Allowed Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.549 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.552 ' CE1' ' SG ' ' A' ' 45' ' ' CYS . 1.4 p90 -158.58 166.69 31.51 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.854 0.359 . . . . 0.0 111.002 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -149.07 112.23 4.92 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.658 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.494 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.6 OUTLIER -83.4 170.93 13.99 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.121 -179.752 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 171.99 178.78 0.07 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.965 -179.879 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.3 p -59.36 173.42 0.51 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.018 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.045 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 . . . . . 0 N--CA 1.455 -0.198 0 CA-C-O 120.865 0.364 . . . . 0.0 110.575 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.5 ' HG2' ' HG2' ' A' ' 76' ' ' ARG . 0.0 OUTLIER -92.01 117.18 29.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.894 -179.919 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -171.23 163.94 7.18 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.239 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 175.86 171.65 0.36 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.876 -180.0 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -179.28 94.0 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.963 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ASP . . . . . 0.583 ' HB2' ' CE2' ' A' ' 75' ' ' TYR . 38.7 t0 -69.02 81.65 0.31 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.731 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 7.3 pttm -41.75 -31.31 0.29 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.907 -179.905 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 8.0 m-30 -51.64 -27.36 11.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.759 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 24.0 p -137.7 -54.47 0.67 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.087 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 126.98 4.06 6.14 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.56 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ASN . . . . . 0.528 ' HB3' ' CE1' ' A' ' 75' ' ' TYR . 2.2 m120 -70.95 149.29 46.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.835 0.35 . . . . 0.0 110.943 -179.937 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 91.7 m -103.54 117.11 33.69 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.992 179.839 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.583 ' CE2' ' HB2' ' A' ' 68' ' ' ASP . 6.5 m-85 -105.79 -160.51 0.75 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.806 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' ARG . . . . . 0.5 ' HG2' ' HG2' ' A' ' 64' ' ' GLU . 0.0 OUTLIER -142.05 133.35 26.4 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.721 179.839 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 55.0 t -49.97 -26.21 2.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.166 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -89.12 21.79 26.07 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.418 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -145.95 135.05 22.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.801 0.334 . . . . 0.0 111.083 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 3.2 p -107.2 171.92 7.11 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.176 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 49.0 p90 -165.28 150.11 9.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.869 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -87.47 133.31 33.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.08 -179.848 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 20.3 ttp180 -132.95 73.02 76.21 Favored Pre-proline 0 C--N 1.327 -0.385 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.708 179.712 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_exo -46.5 152.34 1.54 Allowed 'Trans proline' 0 C--N 1.342 0.219 0 C-N-CA 122.797 2.332 . . . . 0.0 112.589 -179.862 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 5.7 tptp -178.77 160.34 1.15 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.822 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 54.03 35.6 22.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.921 -179.918 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.9 m 60.8 48.17 7.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.868 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -169.68 160.51 8.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.823 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 2.5 mp -100.12 133.66 42.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.983 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' TRP . . . . . 0.524 ' CD1' ' N ' ' A' ' 90' ' ' TRP . 1.4 m95 -134.77 112.78 11.02 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.93 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -68.36 80.99 0.25 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.917 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' CYS . . . . . 0.435 ' HA ' ' HA ' ' A' ' 104' ' ' CYS . 0.6 OUTLIER -54.85 178.79 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.896 179.938 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 97.5 m -157.23 131.2 8.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.095 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 9.2 t -72.25 74.71 0.98 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 -179.881 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.819 HG22 ' CA ' ' A' ' 100' ' ' GLY . 1.0 OUTLIER -78.77 115.64 21.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.369 -179.94 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -149.45 97.5 0.18 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.512 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -159.59 61.26 0.38 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.859 0.361 . . . . 0.0 110.994 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' GLY . . . . . 0.489 ' O ' ' CB ' ' A' ' 99' ' ' ARG . . . 72.28 8.94 71.66 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.54 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.489 ' CB ' ' O ' ' A' ' 98' ' ' GLY . 0.0 OUTLIER 161.24 45.56 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.904 0.383 . . . . 0.0 111.012 -179.985 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 0.819 ' CA ' HG22 ' A' ' 95' ' ' ILE . . . -89.58 -52.61 2.62 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.386 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.484 ' CD ' ' O ' ' A' ' 100' ' ' GLY . 0.0 OUTLIER 48.56 105.7 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.816 0.341 . . . . 0.0 111.107 179.926 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.42 ' C ' ' O ' ' A' ' 101' ' ' ARG . 3.6 mp -36.92 130.82 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.922 179.755 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.41 ' O ' ' HA ' ' A' ' 92' ' ' CYS . 13.2 t -127.66 159.96 33.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.047 -179.785 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.435 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 0.5 OUTLIER -134.15 127.45 32.07 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.801 179.94 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 105' ' ' THR . . . . . 0.542 ' O ' HG23 ' A' ' 105' ' ' THR . 4.8 t -148.15 121.15 8.81 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.271 -179.86 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.464 HD11 ' CH2' ' A' ' 90' ' ' TRP . 2.7 mt -44.15 151.06 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.056 179.902 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -88.15 122.81 32.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.14 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -60.4 145.8 46.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.969 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 2.9 ttp180 . . . . . 0 C--O 1.25 1.088 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.893 179.984 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo . . . . . 0 N--CA 1.465 -0.172 0 CA-C-O 120.842 0.268 . . . . 0.0 112.12 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 20' ' ' GLY . . . . . 0.463 ' CA ' HD11 ' A' ' 30' ' ' ILE . . . 101.45 137.62 9.81 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.474 -179.911 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 2.0 m -84.23 151.25 24.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.781 0.324 . . . . 0.0 110.854 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 82.7 t80 -157.61 109.95 2.39 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.907 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.462 ' OD1' ' N ' ' A' ' 24' ' ' ASN . 38.8 t0 -151.48 157.85 42.86 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.923 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.462 ' N ' ' OD1' ' A' ' 23' ' ' ASP . 30.1 t30 56.54 26.43 11.0 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.932 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 76.17 7.35 84.49 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.465 179.875 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.439 ' HB3' ' CE2' ' A' ' 28' ' ' TYR . 0.1 OUTLIER -116.02 141.38 48.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.856 0.36 . . . . 0.0 110.897 179.946 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 5.2 t-80 -113.58 89.29 3.05 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.041 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.439 ' CE2' ' HB3' ' A' ' 26' ' ' LYS . 94.8 m-85 -87.17 145.19 26.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.806 179.899 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.511 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 10.4 tt0 -62.97 151.68 38.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.091 179.629 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.528 HD12 ' HA2' ' A' ' 49' ' ' GLY . 19.8 mm -50.56 144.28 2.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.935 0.397 . . . . 0.0 110.827 -179.779 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.475 ' HB2' ' O ' ' A' ' 30' ' ' ILE . 5.4 m-20 71.23 3.74 4.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.121 -179.808 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.511 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 29.7 tp60 -80.01 151.14 30.14 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.709 179.582 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.41 ' CG ' HG23 ' A' ' 46' ' ' THR . 25.2 mt-30 -115.37 142.78 46.23 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.783 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' TRP . . . . . 0.425 ' CZ3' ' HB2' ' A' ' 47' ' ' CYS . 40.6 p90 -145.45 171.3 14.84 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.943 0.401 . . . . 0.0 111.072 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 13.8 tm-20 -100.66 140.28 35.16 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.227 -179.763 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -137.18 -167.89 2.19 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.362 179.714 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.559 ' CG2' ' N ' ' A' ' 38' ' ' TYR . 1.8 t -151.2 -51.77 0.13 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.679 0.276 . . . . 0.0 111.55 179.791 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.559 ' N ' ' CG2' ' A' ' 37' ' ' THR . 18.4 t80 44.86 104.97 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.267 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.486 ' CB ' ' O ' ' A' ' 38' ' ' TYR . 1.7 tp 82.77 15.56 0.37 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.779 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 66.13 51.68 42.65 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.81 -0.709 . . . . 0.0 112.717 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.473 ' O ' ' HA ' ' A' ' 37' ' ' THR . 62.2 m-80 -150.95 129.28 12.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.609 0.242 . . . . 0.0 110.983 179.866 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.434 ' O ' ' HA ' ' A' ' 58' ' ' SER . . . -32.96 119.43 0.32 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.032 179.964 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.698 HD12 ' C ' ' A' ' 57' ' ' GLU . 15.0 tp -145.13 146.19 31.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.208 -179.529 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.488 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 4.1 t -130.62 139.07 52.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.551 179.659 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.517 ' SG ' ' CD1' ' A' ' 54' ' ' PHE . 0.4 OUTLIER -123.84 150.45 44.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.291 -179.626 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.545 ' O ' ' CE1' ' A' ' 48' ' ' TYR . 24.1 m -134.74 118.64 17.31 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.85 179.803 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.469 ' SG ' ' HA ' ' A' ' 30' ' ' ILE . 38.1 t -71.01 152.96 43.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.977 0.418 . . . . 0.0 110.932 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.545 ' CE1' ' O ' ' A' ' 46' ' ' THR . 5.3 m-85 -125.78 -31.26 2.94 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.133 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.528 ' HA2' HD12 ' A' ' 30' ' ' ILE . . . 89.55 179.01 45.14 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.5 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 52.73 -113.63 2.91 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.469 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 5.9 m -111.33 -23.74 10.62 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.818 0.342 . . . . 0.0 110.939 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.499 ' HB2' ' HB2' ' A' ' 48' ' ' TYR . 55.8 mtm180 -50.76 -39.42 52.3 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.873 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' GLY . . . . . 0.445 ' O ' ' N ' ' A' ' 48' ' ' TYR . . . 70.53 -131.84 22.16 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.665 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.517 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 3.6 p90 -146.97 162.65 38.31 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.876 0.369 . . . . 0.0 110.961 -179.873 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.471 ' HB3' ' OH ' ' A' ' 48' ' ' TYR . 9.7 t-20 -143.06 126.43 16.67 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.696 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.503 ' HB3' HD21 ' A' ' 43' ' ' LEU . 2.0 m -87.19 166.66 14.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.101 -179.864 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.698 ' C ' HD12 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -171.32 135.58 0.96 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.901 -179.934 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.532 ' N ' HD12 ' A' ' 43' ' ' LEU . 0.1 OUTLIER -50.01 140.17 12.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.053 -179.99 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.783 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 . . . . . 0 N--CA 1.455 -0.216 0 CA-C-O 120.797 0.332 . . . . 0.0 110.614 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.451 ' O ' ' O ' ' A' ' 65' ' ' THR . 0.0 OUTLIER -176.97 161.34 1.93 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.033 -179.969 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.472 ' O ' ' HA ' ' A' ' 97' ' ' ALA . 2.8 p 46.14 -177.84 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.308 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 24.7 p -175.14 162.7 3.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.788 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.504 ' CB ' ' HA2' ' A' ' 98' ' ' GLY . 82.3 t80 -117.97 126.24 51.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.042 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -82.05 105.22 12.97 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.748 179.83 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.64 -1.21 17.96 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.162 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 3.8 m-30 -94.32 -25.13 17.13 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.843 0.354 . . . . 0.0 110.862 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 1.1 p -142.45 -47.96 0.34 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.226 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 113.75 39.99 1.04 Allowed Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.454 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ASN . . . . . 0.492 ' HB3' ' CZ ' ' A' ' 75' ' ' TYR . 0.8 OUTLIER -113.1 120.28 40.76 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.803 0.335 . . . . 0.0 110.788 -179.968 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 41.7 m -69.28 128.51 36.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.013 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.492 ' CZ ' ' HB3' ' A' ' 73' ' ' ASN . 62.1 m-85 -130.97 -171.6 2.61 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.788 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 23.0 mtp85 -103.49 134.8 46.24 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.736 179.875 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 9.0 p -57.46 -22.98 18.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.138 -179.909 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -92.52 23.48 27.73 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.486 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -142.64 128.19 19.07 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.882 0.372 . . . . 0.0 110.886 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.491 ' OG1' ' N ' ' A' ' 81' ' ' TYR . 0.1 OUTLIER -101.29 176.1 5.36 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.061 179.993 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 81' ' ' TYR . . . . . 0.811 ' OH ' HG21 ' A' ' 102' ' ' ILE . 33.8 p90 -154.41 138.25 16.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.861 -179.873 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.406 ' HA ' ' HA ' ' A' ' 91' ' ' ASP . 4.4 mt-10 -69.96 136.57 50.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.006 0.432 . . . . 0.0 110.857 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.442 ' HD3' ' HA ' ' A' ' 83' ' ' ARG . 0.0 OUTLIER -154.14 93.83 2.9 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.83 -179.935 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -66.82 166.74 21.5 Favored 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.737 2.292 . . . . 0.0 112.282 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 178.45 158.73 0.51 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.888 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 38.7 t0 59.28 -89.71 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.861 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 10.4 p -156.34 25.37 0.35 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.942 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' MET . . . . . 0.448 ' O ' ' CD1' ' A' ' 90' ' ' TRP . 0.0 OUTLIER -154.15 152.61 30.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.985 -179.926 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 7.9 mt -92.07 130.6 40.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.054 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' TRP . . . . . 0.573 ' CE3' HG13 ' A' ' 106' ' ' ILE . 0.8 OUTLIER -128.38 129.93 46.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.883 -179.944 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.406 ' HA ' ' HA ' ' A' ' 82' ' ' GLU . 0.7 OUTLIER -83.49 69.91 10.14 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.923 179.925 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 92' ' ' CYS . . . . . 0.461 ' HA ' ' O ' ' A' ' 103' ' ' SER . 0.8 OUTLIER -44.2 127.19 5.49 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.03 -179.954 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.507 ' O ' ' N ' ' A' ' 95' ' ' ILE . 6.0 m -105.59 120.64 42.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.985 179.815 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.835 ' HA ' HG23 ' A' ' 102' ' ' ILE . 0.1 OUTLIER -58.38 77.63 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.949 -179.859 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.507 ' N ' ' O ' ' A' ' 93' ' ' THR . 1.8 mt -89.87 131.59 36.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.259 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 115.38 -142.29 17.51 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.539 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.472 ' HA ' ' O ' ' A' ' 65' ' ' THR . . . -163.27 43.76 0.11 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.864 0.364 . . . . 0.0 110.939 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 98' ' ' GLY . . . . . 0.504 ' HA2' ' CB ' ' A' ' 67' ' ' PHE . . . 93.43 12.6 57.0 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.537 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -167.77 38.05 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.818 0.342 . . . . 0.0 111.01 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 0.408 ' O ' ' HB3' ' A' ' 101' ' ' ARG . . . -118.96 -91.67 1.4 Allowed Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.491 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.408 ' HB3' ' O ' ' A' ' 100' ' ' GLY . 0.0 OUTLIER 168.49 109.67 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.867 0.365 . . . . 0.0 110.875 -179.969 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.835 HG23 ' HA ' ' A' ' 94' ' ' CYS . 1.2 mm -69.69 74.64 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.153 -179.971 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.461 ' O ' ' HA ' ' A' ' 92' ' ' CYS . 13.4 t -41.99 156.56 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.893 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.47 ' SG ' ' HB2' ' A' ' 90' ' ' TRP . 0.0 OUTLIER -138.7 97.25 3.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.902 -179.943 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 4.5 t -103.88 135.57 45.16 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.158 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.573 HG13 ' CE3' ' A' ' 90' ' ' TRP . 2.5 mp -48.99 145.07 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.011 179.935 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -71.35 98.43 1.77 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.086 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -137.2 136.37 38.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.909 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 5.5 mtt-85 . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.18 -0.914 . . . . 0.0 110.889 179.91 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo . . . . . 0 N--CA 1.464 -0.209 0 CA-C-O 120.856 0.273 . . . . 0.0 112.271 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 20' ' ' GLY . . . . . 0.57 ' N ' HD11 ' A' ' 30' ' ' ILE . . . 106.77 -164.05 13.36 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.538 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -155.45 155.49 33.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.794 0.33 . . . . 0.0 110.845 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -142.65 130.59 21.75 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.817 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.41 ' O ' ' N ' ' A' ' 26' ' ' LYS . 1.4 t0 -161.73 144.25 11.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.136 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 44.81 28.79 0.38 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.232 179.782 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 85.25 -10.34 63.99 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.762 179.747 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.41 ' N ' ' O ' ' A' ' 23' ' ' ASP . 0.9 OUTLIER -89.85 140.37 29.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.872 0.367 . . . . 0.0 110.787 179.979 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 33.1 t60 -120.1 92.34 3.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.257 -179.757 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.434 ' CE2' ' CD1' ' A' ' 34' ' ' TRP . 0.1 OUTLIER -83.43 165.24 19.38 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.765 179.713 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.526 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 8.7 tt0 -94.9 145.19 25.08 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.837 179.987 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.702 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.7 mp -48.91 150.81 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.349 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 78.8 m-20 59.84 17.24 6.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.125 179.74 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.526 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 1.1 tt0 -102.88 154.35 19.29 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.838 0.351 . . . . 0.0 110.934 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -120.32 138.71 53.55 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.901 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' TRP . . . . . 0.555 ' CZ3' ' HB2' ' A' ' 47' ' ' CYS . 31.3 p90 -146.36 -176.93 5.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.871 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -108.79 123.46 49.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.024 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.518 ' O ' ' CB ' ' A' ' 43' ' ' LEU . 0.5 OUTLIER -131.75 167.6 19.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.603 179.766 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.477 ' HG1' ' C ' ' A' ' 41' ' ' ASN . 1.6 t -134.23 137.11 44.11 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.919 179.836 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.488 ' O ' ' CB ' ' A' ' 39' ' ' LEU . 22.1 t80 -107.74 108.54 19.81 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.874 -179.837 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.488 ' CB ' ' O ' ' A' ' 38' ' ' TYR . 6.7 tp 82.36 -49.24 0.19 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.821 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 165.16 36.94 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.795 -0.716 . . . . 0.0 112.51 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.477 ' C ' ' HG1' ' A' ' 37' ' ' THR . 68.9 m-80 -141.08 128.78 21.55 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 120.735 0.303 . . . . 0.0 111.053 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.478 ' O ' ' CD1' ' A' ' 43' ' ' LEU . . . -36.16 150.94 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.908 179.856 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.518 ' CB ' ' O ' ' A' ' 36' ' ' ARG . 1.4 tp -167.64 153.6 7.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.906 0.384 . . . . 0.0 111.275 -179.734 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.505 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.3 t -119.81 123.03 70.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.192 179.35 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.515 ' HB2' ' CE2' ' A' ' 34' ' ' TRP . 85.2 m -104.15 159.1 15.97 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.636 -179.141 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.473 ' O ' ' CE1' ' A' ' 48' ' ' TYR . 6.6 m -140.36 116.6 10.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.712 179.639 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.555 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 6.4 t -82.33 133.7 35.24 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.228 -179.569 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.473 ' CE1' ' O ' ' A' ' 46' ' ' THR . 7.1 m-85 -117.38 -27.08 6.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.629 179.864 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 138.67 174.14 13.31 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.227 -179.807 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -75.34 64.62 2.45 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.439 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -173.02 -64.29 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.792 0.33 . . . . 0.0 111.003 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -67.39 -24.95 65.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.242 -179.773 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 70.97 134.79 0.11 Allowed Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.216 -179.746 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.57 ' CD1' ' O ' ' A' ' 54' ' ' PHE . 4.8 p90 -69.98 132.66 46.26 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.942 0.401 . . . . 0.0 111.304 -179.692 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -108.39 140.54 41.53 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.237 179.542 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.505 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 2.4 m -126.63 176.01 7.53 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.992 0.425 . . . . 0.0 111.491 -179.529 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 177.52 -171.57 0.1 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.73 -179.912 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -56.9 141.71 44.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.952 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.965 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.455 -0.219 0 CA-C-O 120.88 0.372 . . . . 0.0 110.573 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 171.49 176.4 0.07 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.999 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 17.5 p 60.86 -177.65 0.11 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.224 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 20.2 t 176.2 129.17 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.854 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.547 ' CE1' ' HA ' ' A' ' 69' ' ' LYS . 53.2 t80 -85.39 108.07 17.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.007 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' ASP . . . . . 0.464 ' O ' ' O ' ' A' ' 69' ' ' LYS . 1.2 t70 -81.34 85.75 6.37 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.737 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.547 ' HA ' ' CE1' ' A' ' 67' ' ' PHE . 0.3 OUTLIER -39.81 164.46 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.905 -179.941 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 70' ' ' TYR . . . . . 0.503 ' CD1' ' N ' ' A' ' 70' ' ' TYR . 2.0 m-30 83.95 -46.31 0.11 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.892 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -111.87 -42.04 3.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.131 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' GLY . . . . . 0.443 ' HA2' ' CE2' ' A' ' 67' ' ' PHE . . . 90.34 5.62 69.58 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.554 -179.963 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 65.9 m-80 -74.01 105.82 5.42 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.845 0.355 . . . . 0.0 110.906 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 26.5 m -54.43 118.03 3.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.013 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.486 ' CE2' ' HB3' ' A' ' 81' ' ' TYR . 17.2 m-30 -110.05 177.58 4.67 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.696 179.894 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' ARG . . . . . 0.476 ' HB2' ' HB2' ' A' ' 79' ' ' ASP . 0.6 OUTLIER -104.37 141.62 36.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.871 179.969 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.463 ' HA ' ' O ' ' A' ' 94' ' ' CYS . 9.0 p -47.8 -29.43 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.138 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -105.8 14.39 45.57 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.499 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ASP . . . . . 0.476 ' HB2' ' HB2' ' A' ' 76' ' ' ARG . 8.9 t70 -112.23 110.92 21.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.896 0.379 . . . . 0.0 110.887 -179.913 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.509 HG22 ' OG1' ' A' ' 93' ' ' THR . 2.7 p -81.89 150.46 27.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.158 179.983 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' TYR . . . . . 0.537 ' OH ' HG21 ' A' ' 102' ' ' ILE . 11.6 p90 -123.17 -33.08 3.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.946 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.469 ' HB3' ' O ' ' A' ' 81' ' ' TYR . 30.7 tt0 76.44 165.75 0.25 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.92 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.4 ' HA ' ' HD2' ' A' ' 84' ' ' PRO . 0.2 OUTLIER -172.39 107.57 0.35 Allowed Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.742 179.964 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.401 ' HA ' ' HA ' ' A' ' 89' ' ' ILE . 49.4 Cg_endo -68.94 89.6 0.44 Allowed 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.716 2.277 . . . . 0.0 112.352 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 10.3 mttt -111.54 137.06 49.87 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.919 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 68.24 9.01 6.96 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.004 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.0 p 69.97 13.19 7.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.947 179.916 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' MET . . . . . 0.417 ' HB3' ' NE1' ' A' ' 90' ' ' TRP . 0.0 OUTLIER -102.1 -23.32 14.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.96 -179.933 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.405 ' O ' ' O ' ' A' ' 88' ' ' MET . 2.9 mp 59.31 122.29 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.12 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 90' ' ' TRP . . . . . 0.563 ' CH2' HD11 ' A' ' 106' ' ' ILE . 4.5 m95 -131.94 109.74 10.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.959 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -57.77 79.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.663 179.82 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 92' ' ' CYS . . . . . 0.702 ' SG ' HG22 ' A' ' 102' ' ' ILE . 0.5 OUTLIER -82.65 152.51 25.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.069 -179.782 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.509 ' OG1' HG22 ' A' ' 80' ' ' THR . 25.9 m -125.71 126.73 45.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.974 179.841 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.608 ' HA ' HD12 ' A' ' 102' ' ' ILE . 0.3 OUTLIER -57.83 80.11 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.024 -179.896 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.488 HG13 ' O ' ' A' ' 93' ' ' THR . 0.9 OUTLIER -97.57 141.43 15.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.199 179.975 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.432 ' HA3' ' HA3' ' A' ' 100' ' ' GLY . . . 127.36 162.74 11.23 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.436 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -96.94 57.92 1.55 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.78 0.324 . . . . 0.0 111.101 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' GLY . . . . . 0.48 ' O ' ' CB ' ' A' ' 99' ' ' ARG . . . 92.72 7.99 62.52 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.506 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.48 ' CB ' ' O ' ' A' ' 98' ' ' GLY . 0.0 OUTLIER 162.21 38.88 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.88 0.371 . . . . 0.0 110.836 -179.92 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 0.432 ' HA3' ' HA3' ' A' ' 96' ' ' GLY . . . -76.8 -86.96 0.37 Allowed Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.491 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.558 ' N ' ' CD ' ' A' ' 101' ' ' ARG . 0.0 OUTLIER -176.12 94.91 0.06 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.831 0.348 . . . . 0.0 110.996 179.875 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.702 HG22 ' SG ' ' A' ' 92' ' ' CYS . 2.4 mm -58.59 99.43 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.951 179.734 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.416 ' C ' ' SG ' ' A' ' 92' ' ' CYS . 1.4 t -73.06 125.51 27.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.128 -179.82 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.472 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 59.2 m -108.32 164.17 12.55 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.834 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 3.2 t -178.27 149.45 0.53 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.181 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.563 HD11 ' CH2' ' A' ' 90' ' ' TRP . 5.0 mt -82.41 137.79 20.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.078 179.843 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -158.18 150.47 22.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.133 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' ASN . . . . . 0.482 ' O ' ' CB ' ' A' ' 109' ' ' ARG . 8.7 t30 179.49 59.29 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.918 -179.998 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 109' ' ' ARG . . . . . 0.482 ' CB ' ' O ' ' A' ' 108' ' ' ASN . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.244 -0.884 . . . . 0.0 110.887 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.48 ' O ' HG13 ' A' ' 30' ' ' ILE . 35.1 Cg_exo . . . . . 0 C--O 1.231 0.164 0 CA-C-O 120.894 0.289 . . . . 0.0 112.33 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' GLY . . . . . 0.469 ' HA2' HG13 ' A' ' 30' ' ' ILE . . . -70.73 -148.78 0.5 Allowed Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.443 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 81.0 m -134.83 93.76 3.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.912 0.387 . . . . 0.0 110.956 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -47.91 147.89 1.85 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.023 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.43 ' O ' ' CG ' ' A' ' 24' ' ' ASN . 14.2 t0 -178.3 131.85 0.14 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.767 179.977 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.43 ' CG ' ' O ' ' A' ' 23' ' ' ASP . 10.1 p30 51.04 22.92 1.34 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.989 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 88.64 -10.18 73.1 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.508 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.418 ' HB3' ' CZ ' ' A' ' 28' ' ' TYR . 0.1 OUTLIER -92.56 131.29 37.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.795 0.331 . . . . 0.0 110.835 179.963 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 14.7 t-160 -113.87 91.08 3.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.145 -179.704 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.469 ' O ' ' HA3' ' A' ' 20' ' ' GLY . 0.5 OUTLIER -79.76 176.9 9.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.802 179.837 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.529 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 0.0 OUTLIER -91.11 148.11 22.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.953 -179.946 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.692 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.7 mp -48.07 148.76 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.298 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 11.6 m-20 62.79 15.54 8.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.197 179.689 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.529 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 15.1 tt0 -98.14 150.36 21.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.804 0.335 . . . . 0.0 110.727 179.864 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.968 ' HG2' HG23 ' A' ' 46' ' ' THR . 8.8 mt-30 -110.21 156.17 21.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.086 -179.737 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' TRP . . . . . 0.584 ' CH2' ' O ' ' A' ' 46' ' ' THR . 48.6 p90 -162.56 -170.9 2.55 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.76 179.603 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -112.39 132.82 54.81 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.41 -179.581 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.521 ' O ' ' N ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -134.17 -174.1 3.45 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.22 179.548 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.444 ' HG1' ' C ' ' A' ' 41' ' ' ASN . 1.7 t -145.53 134.93 23.1 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.963 0.411 . . . . 0.0 111.312 179.942 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.462 ' CB ' HD22 ' A' ' 43' ' ' LEU . 1.6 t80 -128.95 122.75 30.85 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.597 179.696 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.443 ' CB ' ' O ' ' A' ' 38' ' ' TYR . 1.5 tp 78.85 8.71 1.96 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.663 -179.595 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 89.12 41.59 5.82 Favored Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.995 -0.622 . . . . 0.0 112.754 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.444 ' C ' ' HG1' ' A' ' 37' ' ' THR . 65.2 m-80 -152.14 136.85 17.01 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.681 0.277 . . . . 0.0 111.069 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.43 ' C ' ' O ' ' A' ' 41' ' ' ASN . . . -37.08 152.25 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.643 179.659 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.521 ' N ' ' O ' ' A' ' 36' ' ' ARG . 2.6 tp -167.15 156.56 10.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.02 0.438 . . . . 0.0 111.535 -179.537 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.505 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 15.2 t -110.09 155.54 11.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.693 178.927 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.574 ' SG ' ' CD1' ' A' ' 54' ' ' PHE . 0.1 OUTLIER -161.22 174.02 14.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.112 0.482 . . . . 0.0 111.6 -179.502 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.968 HG23 ' HG2' ' A' ' 33' ' ' GLN . 0.2 OUTLIER -138.79 -167.58 2.24 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.746 179.878 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.523 ' H ' HG22 ' A' ' 46' ' ' THR . 46.4 t -134.82 140.45 45.86 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.94 0.4 . . . . 0.0 111.019 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -110.54 -36.94 5.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.776 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.478 ' O ' ' N ' ' A' ' 51' ' ' SER . . . 127.18 163.66 11.49 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.406 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' GLY . . . . . 0.42 ' C ' ' O ' ' A' ' 49' ' ' GLY . . . 36.1 29.86 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.693 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' SER . . . . . 0.478 ' N ' ' O ' ' A' ' 49' ' ' GLY . 0.1 OUTLIER 49.65 35.24 8.35 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.86 0.362 . . . . 0.0 111.006 179.935 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.46 ' HG3' ' O ' ' A' ' 49' ' ' GLY . 9.7 mtp85 -58.83 -51.91 67.97 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.723 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 156.83 89.75 0.07 OUTLIER Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.613 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.574 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 1.8 p90 -58.17 -172.03 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.836 0.35 . . . . 0.0 110.813 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -136.13 114.09 11.29 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.76 179.89 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.505 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 13.3 m -94.61 -178.64 4.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.01 -179.855 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.504 ' O ' HD11 ' A' ' 43' ' ' LEU . 0.1 OUTLIER -171.95 -92.29 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.023 -179.996 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.485 ' HA ' ' HA ' ' A' ' 43' ' ' LEU . 0.2 OUTLIER 175.81 -177.16 0.12 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.914 -179.91 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 1.3 mmmt . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.915 -179.935 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.232 0.174 0 CA-C-O 120.799 0.333 . . . . 0.0 110.635 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.457 ' HG2' ' O ' ' A' ' 64' ' ' GLU . 17.4 tt0 -177.29 39.54 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.889 179.969 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.406 ' C ' ' SG ' ' A' ' 66' ' ' CYS . 7.1 p -146.7 -166.16 2.42 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.129 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.473 ' O ' ' HB3' ' A' ' 67' ' ' PHE . 0.0 OUTLIER -157.02 -63.66 0.1 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.888 -179.934 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.473 ' HB3' ' O ' ' A' ' 66' ' ' CYS . 24.3 t80 79.76 92.25 0.05 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.806 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' ASP . . . . . 0.89 ' OD1' HD13 ' A' ' 102' ' ' ILE . 0.6 OUTLIER -88.69 44.4 1.2 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.988 -179.96 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.606 ' HG3' ' CD1' ' A' ' 70' ' ' TYR . 2.2 ptmt 36.16 -144.52 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.728 179.836 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' TYR . . . . . 0.606 ' CD1' ' HG3' ' A' ' 69' ' ' LYS . 9.4 m-30 79.95 -50.33 0.37 Allowed 'General case' 0 C--O 1.231 0.129 0 CA-C-O 120.722 0.296 . . . . 0.0 110.854 -179.687 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 5.3 t -171.37 -35.88 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.26 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 141.41 55.88 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.554 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 24.0 m-80 -104.44 49.53 0.81 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.738 0.304 . . . . 0.0 110.963 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.435 HG23 ' O ' ' A' ' 74' ' ' THR . 4.5 t -43.0 128.19 4.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.128 179.96 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.489 ' CE2' ' CE2' ' A' ' 81' ' ' TYR . 52.3 m-85 -108.06 -179.93 4.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.941 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 2.8 tpp180 -112.65 132.15 55.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.829 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.997 HG21 ' HB2' ' A' ' 97' ' ' ALA . 11.7 p -54.18 -19.5 3.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.091 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -111.7 34.96 4.96 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.529 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -154.1 125.62 7.53 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.888 0.375 . . . . 0.0 111.022 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 58.8 p -78.5 168.24 20.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.04 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' TYR . . . . . 0.506 ' CZ ' ' CB ' ' A' ' 92' ' ' CYS . 22.3 p90 -166.38 167.47 15.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.859 -179.891 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.414 ' HB3' ' HA ' ' A' ' 91' ' ' ASP . 0.0 OUTLIER -138.99 132.45 30.25 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.849 179.89 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.423 ' HD2' ' OH ' ' A' ' 75' ' ' TYR . 3.3 mtp180 -136.2 140.91 34.26 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.023 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_endo -77.78 124.32 6.81 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.853 2.369 . . . . 0.0 112.327 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.535 ' O ' ' CB ' ' A' ' 86' ' ' ASP . 12.4 tppt? -129.27 108.37 10.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.879 179.845 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.535 ' CB ' ' O ' ' A' ' 85' ' ' LYS . 6.7 t0 87.86 -35.18 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.03 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 87' ' ' SER . . . . . 0.5 ' CB ' ' O ' ' A' ' 86' ' ' ASP . 0.4 OUTLIER 159.02 -23.33 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.771 -179.999 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -98.32 154.84 17.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.875 -179.889 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 14.0 mt -106.05 135.0 46.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.072 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' TRP . . . . . 0.611 ' CD1' ' N ' ' A' ' 90' ' ' TRP . 0.1 OUTLIER -130.23 130.78 45.07 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.832 179.955 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.414 ' HA ' ' HB3' ' A' ' 82' ' ' GLU . 60.2 m-20 -72.58 62.41 0.55 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.942 -179.878 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 92' ' ' CYS . . . . . 0.506 ' CB ' ' CZ ' ' A' ' 81' ' ' TYR . 57.1 m -48.91 145.23 4.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.0 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.445 ' O ' ' N ' ' A' ' 95' ' ' ILE . 10.6 m -132.15 125.42 31.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.038 179.843 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 45.3 t -61.59 77.87 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.854 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.445 ' N ' ' O ' ' A' ' 93' ' ' THR . 1.5 mt -90.75 84.55 2.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.307 -179.84 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 157.1 -23.4 0.46 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.455 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.997 ' HB2' HG21 ' A' ' 77' ' ' VAL . . . 59.56 44.09 15.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.855 0.36 . . . . 0.0 111.042 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 159.63 -55.69 0.34 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.528 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 178.99 44.65 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.809 0.337 . . . . 0.0 110.973 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -74.61 -64.81 2.28 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.489 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.512 ' O ' ' N ' ' A' ' 103' ' ' SER . 1.5 ptt180 -177.7 62.79 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.725 0.298 . . . . 0.0 110.94 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.89 HD13 ' OD1' ' A' ' 68' ' ' ASP . 13.2 mt -36.15 91.94 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.135 -179.93 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.512 ' N ' ' O ' ' A' ' 101' ' ' ARG . 0.3 OUTLIER -74.23 145.98 43.67 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.815 179.986 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 29.7 m -146.27 137.78 24.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.828 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 3.4 t -143.1 127.19 17.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.15 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.572 HG13 ' CE3' ' A' ' 90' ' ' TRP . 3.0 mt -41.6 126.01 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.033 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -107.49 105.78 15.85 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.07 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 108' ' ' ASN . . . . . 0.503 ' O ' ' CB ' ' A' ' 109' ' ' ARG . 4.6 m-20 -69.02 82.1 0.31 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.904 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 109' ' ' ARG . . . . . 0.503 ' CB ' ' O ' ' A' ' 108' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.195 -0.907 . . . . 0.0 110.9 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo . . . . . 0 N--CA 1.462 -0.356 0 CA-C-O 120.787 0.245 . . . . 0.0 112.419 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 20' ' ' GLY . . . . . 0.454 ' HA2' HG13 ' A' ' 30' ' ' ILE . . . 126.86 -173.88 18.26 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.682 -0.771 . . . . 0.0 112.611 179.934 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 3.3 m -145.91 91.76 2.12 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.852 0.358 . . . . 0.0 110.779 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -57.3 129.59 42.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.003 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.455 ' OD2' ' CE2' ' A' ' 54' ' ' PHE . 0.4 OUTLIER -161.65 135.17 6.47 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.82 179.98 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.424 ' CG ' ' O ' ' A' ' 24' ' ' ASN . 36.3 t30 62.28 38.96 12.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.865 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 60.47 17.45 47.72 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.622 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.578 ' HB3' ' CE1' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -133.05 137.82 46.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.848 0.356 . . . . 0.0 110.949 -179.985 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 51.9 t-80 -105.38 96.87 6.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.834 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.578 ' CE1' ' HB3' ' A' ' 26' ' ' LYS . 10.4 m-30 -79.68 170.54 16.38 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.804 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.489 ' O ' ' HB2' ' A' ' 32' ' ' GLN . 4.8 tm0? -89.93 130.98 36.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.504 179.742 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.65 HD12 ' H ' ' A' ' 30' ' ' ILE . 4.3 mp -33.99 148.22 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.924 0.393 . . . . 0.0 111.383 -179.845 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.423 ' HB2' ' O ' ' A' ' 30' ' ' ILE . 34.1 m-20 76.47 4.53 3.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.847 -179.672 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.489 ' HB2' ' O ' ' A' ' 29' ' ' GLN . 7.2 tp60 -91.08 134.38 34.56 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.582 179.712 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.449 ' O ' ' NE2' ' A' ' 32' ' ' GLN . 20.9 mt-30 -103.17 148.31 25.93 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.034 -179.792 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' TRP . . . . . 0.551 ' CZ2' ' HB3' ' A' ' 45' ' ' CYS . 35.5 p90 -157.28 179.01 9.67 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.672 179.886 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.69 ' OE2' ' HB1' ' A' ' 42' ' ' ALA . 0.2 OUTLIER -118.54 122.16 42.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.904 0.383 . . . . 0.0 111.377 -179.551 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.9 ' O ' HD22 ' A' ' 43' ' ' LEU . 3.8 ttt85 -114.59 141.53 47.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.528 179.592 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.532 ' CG2' ' N ' ' A' ' 38' ' ' TYR . 1.4 m -102.03 162.35 12.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.037 -179.782 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.532 ' N ' ' CG2' ' A' ' 37' ' ' THR . 13.0 t80 177.02 115.26 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.754 179.947 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.443 ' HA ' HD12 ' A' ' 39' ' ' LEU . 0.8 OUTLIER 74.66 34.43 0.74 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.831 -179.864 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 68.04 30.55 74.08 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.43 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.423 ' O ' ' HA ' ' A' ' 37' ' ' THR . 13.0 m120 -134.12 146.0 49.84 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 120.837 0.351 . . . . 0.0 110.962 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.892 ' C ' HD13 ' A' ' 43' ' ' LEU . . . -100.08 112.34 24.63 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.999 179.896 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.9 HD22 ' O ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -112.81 143.41 44.1 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.013 -179.989 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.497 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.7 t -93.7 126.9 46.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.348 179.261 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.57 ' SG ' ' CE1' ' A' ' 54' ' ' PHE . 6.2 m -105.64 166.94 10.1 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.698 -179.207 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.455 ' O ' ' HA ' ' A' ' 54' ' ' PHE . 26.0 m -150.49 124.47 9.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.679 179.642 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.485 ' SG ' ' HA ' ' A' ' 30' ' ' ILE . 15.1 t -79.79 130.39 35.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.032 -179.712 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -111.97 -25.59 9.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.93 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 94.58 -179.14 37.13 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.451 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 42.59 -129.69 5.0 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.59 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -89.33 -27.97 20.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.825 0.345 . . . . 0.0 110.979 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -49.69 -29.52 7.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.964 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 50.11 -125.37 19.95 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.629 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.57 ' CE1' ' SG ' ' A' ' 45' ' ' CYS . 1.1 p90 -132.85 160.2 37.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.829 0.347 . . . . 0.0 110.902 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -138.23 85.47 2.1 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.713 179.79 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.497 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.1 OUTLIER -63.3 158.9 19.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.045 -179.741 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -137.65 -70.13 0.44 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.844 179.921 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.484 ' HA ' ' HA ' ' A' ' 43' ' ' LEU . 85.0 p -172.59 176.86 3.12 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.822 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 46.3 tptt . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.78 180.0 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.422 ' O ' ' N ' ' A' ' 65' ' ' THR . 1.3 tt0 . . . . . 0 N--CA 1.456 -0.174 0 CA-C-O 120.897 0.38 . . . . 0.0 110.43 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 87.9 mt-10 -62.33 78.59 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.806 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.422 ' N ' ' O ' ' A' ' 63' ' ' GLU . 7.3 p -142.45 150.67 40.88 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.189 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.422 ' SG ' ' HB2' ' A' ' 75' ' ' TYR . 0.3 OUTLIER -152.02 178.73 9.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.613 179.924 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 12.0 t80 -168.73 100.94 0.4 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.966 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' ASP . . . . . 0.477 ' O ' ' O ' ' A' ' 69' ' ' LYS . 28.2 t0 -101.97 32.52 3.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.855 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.504 ' HD2' ' CE1' ' A' ' 70' ' ' TYR . 0.0 OUTLIER 39.07 -165.76 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.153 179.808 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 70' ' ' TYR . . . . . 0.504 ' CE1' ' HD2' ' A' ' 69' ' ' LYS . 12.4 m-85 74.56 -54.62 0.67 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.131 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -127.33 -4.25 6.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.295 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 51.69 26.13 16.22 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.361 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ASN . . . . . 0.541 ' O ' ' CE1' ' A' ' 75' ' ' TYR . 35.7 t-20 -77.04 90.88 3.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.739 0.305 . . . . 0.0 110.965 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 56.2 m -49.52 119.41 3.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.036 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.541 ' CE1' ' O ' ' A' ' 73' ' ' ASN . 9.9 m-85 -102.95 172.8 6.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.818 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -111.92 133.55 54.04 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.781 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.447 ' HA ' ' HB3' ' A' ' 94' ' ' CYS . 53.1 t -49.4 -37.15 10.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.06 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -85.14 41.67 3.08 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.498 179.869 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -164.32 178.32 7.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.83 0.348 . . . . 0.0 110.993 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' THR . . . . . 1.052 HG22 HG23 ' A' ' 93' ' ' THR . 19.1 p -132.7 151.28 52.01 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.059 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 24.0 p90 -136.72 115.19 11.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.876 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -82.18 112.99 19.7 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.798 179.952 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.2 106.0 53.47 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.921 -179.924 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.466 ' HB3' HG12 ' A' ' 89' ' ' ILE . 71.5 Cg_endo -74.66 141.27 27.51 Favored 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.816 2.344 . . . . 0.0 112.303 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.462 ' O ' ' CB ' ' A' ' 86' ' ' ASP . 12.3 tptp -151.51 99.15 2.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.948 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.462 ' CB ' ' O ' ' A' ' 85' ' ' LYS . 0.3 OUTLIER 80.31 -167.54 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.907 -179.969 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.65 55.97 2.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.87 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 2.9 ptp -145.52 -60.97 0.34 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.881 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.466 HG12 ' HB3' ' A' ' 84' ' ' PRO . 60.9 mt 62.45 130.47 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.179 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 90' ' ' TRP . . . . . 0.614 ' CD1' ' N ' ' A' ' 90' ' ' TRP . 0.0 OUTLIER -137.65 172.76 12.48 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.884 179.971 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -110.24 82.68 1.63 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.902 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 23.2 m -68.77 135.05 50.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.981 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' THR . . . . . 1.052 HG23 HG22 ' A' ' 80' ' ' THR . 0.8 OUTLIER -115.91 174.76 5.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.924 179.782 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.633 ' H ' HG22 ' A' ' 93' ' ' THR . 36.7 t -108.99 40.27 1.85 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.87 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 2.0 mt -56.76 110.68 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.38 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 140.74 135.86 3.25 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.497 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -60.97 -14.77 24.98 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.838 0.352 . . . . 0.0 111.113 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' GLY . . . . . 0.42 ' O ' ' HB3' ' A' ' 99' ' ' ARG . . . -144.08 24.98 2.07 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.535 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.624 ' HG2' HD11 ' A' ' 102' ' ' ILE . 4.5 tmm_? 64.8 132.22 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.843 0.354 . . . . 0.0 110.928 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 165.76 -36.04 0.26 Allowed Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.42 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 3.1 mtm-85 -102.52 43.12 1.09 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.832 0.348 . . . . 0.0 110.846 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.673 ' H ' HD12 ' A' ' 102' ' ' ILE . 5.2 mp -54.41 95.47 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.142 -179.821 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.72 124.66 28.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.649 179.774 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.523 ' SG ' HG22 ' A' ' 102' ' ' ILE . 4.1 m -129.04 121.96 28.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.994 -179.921 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 1.1 t -135.83 139.88 43.79 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.985 179.881 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.541 ' O ' ' HB2' ' A' ' 107' ' ' ALA . 2.6 mt -61.1 143.05 15.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.101 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.541 ' HB2' ' O ' ' A' ' 106' ' ' ILE . . . 171.6 117.79 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.116 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 12.2 p-10 -163.68 116.47 1.47 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.85 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 18.3 ttp180 . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.267 -0.873 . . . . 0.0 110.9 179.912 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo . . . . . 0 C--O 1.231 0.147 0 CA-C-O 120.845 0.269 . . . . 0.0 112.265 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 114.43 167.6 15.89 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.648 -0.786 . . . . 0.0 112.536 179.873 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 8.9 p -152.59 123.34 7.38 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.793 0.33 . . . . 0.0 110.847 -180.0 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 7.0 t80 -92.08 95.4 9.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.924 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.446 ' OD2' ' CE1' ' A' ' 54' ' ' PHE . 1.2 m-20 -117.0 139.61 50.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.821 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.464 ' OD1' ' O ' ' A' ' 24' ' ' ASN . 27.5 t-20 50.09 45.59 25.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.709 -179.959 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.12 16.86 28.09 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.363 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.95 152.56 47.74 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.818 0.342 . . . . 0.0 110.936 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 20.9 t-80 -116.85 97.97 6.25 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.136 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 15.6 m-85 -79.87 -178.72 6.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.854 179.849 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.495 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 2.1 tt0 -93.64 120.65 34.18 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.588 179.709 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.705 HD12 ' H ' ' A' ' 30' ' ' ILE . 4.4 mp -33.86 138.91 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.353 -179.825 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.488 ' N ' ' O ' ' A' ' 47' ' ' CYS . 34.3 m-20 76.97 5.35 3.31 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.762 -179.686 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.495 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 11.8 tt0 -86.61 154.19 21.22 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.774 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.965 ' CG ' HG23 ' A' ' 46' ' ' THR . 36.5 mt-30 -122.64 124.84 44.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.15 -179.683 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' TRP . . . . . 0.548 ' CZ3' ' HB2' ' A' ' 47' ' ' CYS . 22.9 p90 -131.0 175.63 8.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.791 179.742 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 33.6 tp10 -100.18 126.64 46.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.863 0.363 . . . . 0.0 111.313 -179.86 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.451 ' O ' ' O ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -138.25 -161.93 1.24 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.468 179.643 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.471 ' HG1' ' C ' ' A' ' 41' ' ' ASN . 2.2 t -143.83 141.46 30.37 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.952 0.406 . . . . 0.0 111.452 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.769 ' HB2' HD22 ' A' ' 43' ' ' LEU . 9.8 t80 -131.17 132.73 44.94 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.461 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.4 mp 63.44 16.96 9.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.947 0.404 . . . . 0.0 110.319 -179.53 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 83.41 37.07 12.74 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.938 -0.649 . . . . 0.0 112.563 -179.871 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.471 ' C ' ' HG1' ' A' ' 37' ' ' THR . 64.1 m-80 -146.55 139.7 25.58 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 120.77 0.319 . . . . 0.0 111.075 -179.9 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -48.04 134.19 14.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.835 179.739 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.845 HD12 ' O ' ' A' ' 57' ' ' GLU . 0.0 OUTLIER -165.36 147.44 7.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.02 0.438 . . . . 0.0 110.954 -179.752 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.465 ' O ' ' HB3' ' A' ' 56' ' ' CYS . 5.1 t -90.11 134.46 29.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.809 179.822 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.488 ' HA ' ' HA ' ' A' ' 56' ' ' CYS . 5.4 m -119.65 123.4 43.77 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.107 -179.706 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.965 HG23 ' CG ' ' A' ' 33' ' ' GLN . 0.2 OUTLIER -94.77 -174.04 3.17 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.003 179.868 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.659 ' H ' HG22 ' A' ' 46' ' ' THR . 27.8 t -138.69 119.8 14.55 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.85 0.357 . . . . 0.0 110.88 -179.843 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 9.9 m-30 -90.91 -46.32 8.25 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.261 -179.871 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 103.14 166.33 25.81 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.45 -179.737 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 65.31 -116.83 9.23 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.612 179.846 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 4.9 p -125.11 -6.85 7.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.731 0.301 . . . . 0.0 111.187 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 4.0 mtm180 -56.91 -29.28 62.91 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.897 0.379 . . . . 0.0 110.876 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 64.33 137.2 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.729 179.828 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.528 ' CB ' ' O ' ' A' ' 46' ' ' THR . 38.5 p90 -59.28 -167.8 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.574 0.226 . . . . 0.0 110.671 179.737 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.524 ' O ' ' CB ' ' A' ' 56' ' ' CYS . 2.3 t30 -147.16 -49.95 0.19 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.821 0.343 . . . . 0.0 111.601 -179.739 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.524 ' CB ' ' O ' ' A' ' 55' ' ' ASN . 5.2 m 85.62 -172.64 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.424 -179.611 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.845 ' O ' HD12 ' A' ' 43' ' ' LEU . 3.9 tt0 -156.78 -89.23 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.858 0.361 . . . . 0.0 111.359 -179.837 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.468 ' HA ' ' HA ' ' A' ' 43' ' ' LEU . 0.3 OUTLIER 170.97 146.44 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.835 -179.701 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.813 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.407 ' HG3' HG11 ' A' ' 77' ' ' VAL . 0.1 OUTLIER . . . . . 0 N--CA 1.456 -0.144 0 CA-C-O 120.841 0.353 . . . . 0.0 110.55 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -163.86 139.4 6.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.84 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.503 ' OG1' ' CG2' ' A' ' 74' ' ' THR . 12.6 p -57.95 -176.63 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.273 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 60.1 m -114.46 156.43 24.56 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.944 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 89.8 t80 -112.35 87.6 2.61 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.972 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.95 85.96 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.937 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 4.2 ptmt -41.08 -28.2 0.08 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.869 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 14.6 m-30 -40.02 -72.74 0.06 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.924 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.516 HG22 ' O ' ' A' ' 71' ' ' THR . 6.3 m -117.78 20.79 13.25 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.099 179.817 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 55.95 54.23 36.74 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.46 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ASN . . . . . 0.434 ' OD1' ' HB ' ' A' ' 71' ' ' THR . 0.4 OUTLIER -108.41 -162.9 0.84 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.763 0.316 . . . . 0.0 110.846 179.949 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.503 ' CG2' ' OG1' ' A' ' 65' ' ' THR . 1.1 m -146.01 133.05 20.3 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.065 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.443 ' O ' ' HB ' ' A' ' 65' ' ' THR . 2.7 m-85 -123.22 128.64 50.29 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.859 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 2.7 mmt180 -45.55 137.5 5.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.849 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.42 ' HA ' ' SG ' ' A' ' 94' ' ' CYS . 12.2 p -82.09 -17.03 11.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.194 -179.912 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -102.04 9.38 56.45 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.446 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -138.52 159.26 42.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.828 0.347 . . . . 0.0 110.896 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.497 ' OG1' ' N ' ' A' ' 81' ' ' TYR . 0.1 OUTLIER -106.59 -173.4 2.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.989 179.943 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 81' ' ' TYR . . . . . 0.532 ' CZ ' ' HB3' ' A' ' 92' ' ' CYS . 15.2 p90 -164.74 -177.81 4.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.868 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -135.2 110.54 9.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.82 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.61 96.05 9.7 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.904 -179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -69.78 84.37 0.66 Allowed 'Trans proline' 0 C--O 1.231 0.145 0 C-N-CA 122.78 2.32 . . . . 0.0 112.227 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.87 139.37 32.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.91 179.887 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 46.32 -157.89 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.935 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' SER . . . . . 0.432 ' O ' ' HB2' ' A' ' 88' ' ' MET . 0.4 OUTLIER -84.03 62.8 7.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.931 -179.986 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 88' ' ' MET . . . . . 0.432 ' HB2' ' O ' ' A' ' 87' ' ' SER . 1.3 ttt 174.44 149.6 0.08 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.926 -179.944 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.534 ' C ' ' CD1' ' A' ' 90' ' ' TRP . 17.1 mt -110.37 157.79 10.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.124 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 90' ' ' TRP . . . . . 0.778 ' CZ3' HD11 ' A' ' 106' ' ' ILE . 0.1 OUTLIER -146.0 134.08 21.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.948 179.989 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 29.2 t0 -72.41 62.8 0.53 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.774 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' CYS . . . . . 0.532 ' HB3' ' CZ ' ' A' ' 81' ' ' TYR . 67.9 m -55.49 146.04 21.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.052 -179.87 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.477 ' O ' ' N ' ' A' ' 95' ' ' ILE . 21.2 m -144.03 141.31 30.04 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.96 179.806 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.42 ' SG ' ' HA ' ' A' ' 77' ' ' VAL . 50.3 t -66.29 60.21 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.975 -179.759 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.603 HD12 ' CB ' ' A' ' 103' ' ' SER . 2.6 mt -68.77 80.17 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.001 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -114.34 -107.15 2.71 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.462 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . 55.09 79.79 0.14 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.748 0.309 . . . . 0.0 111.085 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 82.65 -55.28 4.99 Favored Glycine 0 N--CA 1.453 -0.207 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.448 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 6.8 mtt180 -179.12 63.23 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.889 0.376 . . . . 0.0 110.965 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 0.459 ' O ' ' HB3' ' A' ' 101' ' ' ARG . . . -89.28 -28.21 20.73 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.528 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.517 ' N ' ' O ' ' A' ' 95' ' ' ILE . 0.0 OUTLIER 66.8 104.24 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.81 0.338 . . . . 0.0 110.9 179.952 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.476 HG21 ' OH ' ' A' ' 81' ' ' TYR . 2.5 mp -36.32 128.36 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.126 179.81 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.603 ' CB ' HD12 ' A' ' 95' ' ' ILE . 29.2 t -110.21 163.08 13.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.077 -179.911 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 82.3 m -154.49 119.9 5.09 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.935 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 22.1 m -133.45 124.7 27.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.167 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.778 HD11 ' CZ3' ' A' ' 90' ' ' TRP . 2.4 mp -58.79 87.67 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.116 179.965 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -108.28 141.95 39.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.197 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -79.74 134.15 36.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.935 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.814 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.466 ' C ' HD11 ' A' ' 30' ' ' ILE . 94.7 Cg_endo . . . . . 0 N--CA 1.463 -0.297 0 CA-C-O 120.733 0.222 . . . . 0.0 112.386 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 176.81 -161.66 29.63 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.515 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -159.15 178.38 10.08 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.779 0.323 . . . . 0.0 110.878 -179.946 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 48.2 t80 -161.89 126.67 3.38 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.945 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -163.83 159.21 20.9 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.931 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 46.19 31.96 1.34 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.914 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 65.83 21.31 69.27 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.56 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.26 152.32 44.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.831 0.348 . . . . 0.0 110.91 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -117.29 96.47 5.44 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.136 -179.689 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -88.53 -162.45 0.85 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.9 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.524 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 0.5 OUTLIER -124.83 156.7 37.4 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.756 179.868 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.679 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.5 mp -51.99 150.46 1.04 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.37 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.125 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 17.5 m-20 64.87 13.93 8.88 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.776 -179.871 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.524 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 12.9 tt0 -98.54 145.53 26.71 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.792 -179.979 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.727 ' HG2' HG23 ' A' ' 46' ' ' THR . 8.0 mt-30 -118.01 143.69 46.19 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.848 -179.78 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' TRP . . . . . 0.598 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 35.9 p90 -144.13 -172.07 3.69 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.829 179.83 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -116.08 133.14 56.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.928 0.394 . . . . 0.0 111.239 -179.814 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.4 171.24 14.77 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.502 179.72 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -134.69 142.8 46.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.937 0.398 . . . . 0.0 110.787 -179.841 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.502 ' CB ' HD22 ' A' ' 43' ' ' LEU . 0.7 OUTLIER -155.21 120.46 4.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.686 179.671 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.517 HD12 ' HA ' ' A' ' 39' ' ' LEU . 1.6 tp 80.91 22.62 0.36 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.58 -179.732 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 68.19 37.71 87.11 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.918 -0.658 . . . . 0.0 112.438 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.434 ' O ' ' C ' ' A' ' 42' ' ' ALA . 51.1 m-80 -148.35 133.37 18.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.667 0.27 . . . . 0.0 110.945 179.919 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.434 ' C ' ' O ' ' A' ' 41' ' ' ASN . . . -35.69 153.92 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.801 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.502 HD22 ' CB ' ' A' ' 38' ' ' TYR . 3.1 tp -161.52 146.05 13.2 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.144 -179.543 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.493 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 3.9 t -121.61 136.85 57.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.417 179.547 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.598 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 0.7 OUTLIER -116.41 161.39 19.14 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.322 -179.509 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.727 HG23 ' HG2' ' A' ' 33' ' ' GLN . 1.4 m -144.29 127.73 16.93 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.936 179.818 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.525 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 19.4 t -87.28 138.61 31.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.057 -179.868 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.554 ' C ' HG23 ' A' ' 30' ' ' ILE . 11.6 m-85 -122.4 -33.13 3.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.928 179.953 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.42 ' O ' ' HB2' ' A' ' 52' ' ' ARG . . . 64.75 -165.7 32.82 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.498 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' GLY . . . . . 0.501 ' O ' ' CB ' ' A' ' 51' ' ' SER . . . 56.65 31.13 60.19 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.523 -179.941 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' SER . . . . . 0.501 ' CB ' ' O ' ' A' ' 50' ' ' GLY . 0.8 OUTLIER 83.88 -10.01 0.95 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.706 0.289 . . . . 0.0 110.995 -179.978 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.42 ' HB2' ' O ' ' A' ' 49' ' ' GLY . 34.1 mtt85 -67.85 -46.78 70.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.021 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 92.47 -141.33 15.53 Favored Glycine 0 N--CA 1.446 -0.638 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.608 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.568 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 5.8 p90 -143.27 157.0 44.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.844 0.354 . . . . 0.0 110.92 -179.947 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 -131.57 124.89 30.97 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.809 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.493 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.5 OUTLIER -100.5 163.15 12.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.021 -179.963 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.466 ' O ' ' HA ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -175.02 -177.62 1.1 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.937 179.898 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -65.95 178.58 1.07 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.932 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.891 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.406 ' O ' ' HB1' ' A' ' 97' ' ' ALA . 2.7 tt0 . . . . . 0 N--CA 1.446 -0.632 0 CA-C-O 120.811 0.338 . . . . 0.0 111.165 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.704 ' O ' HG23 ' A' ' 65' ' ' THR . 3.1 mt-10 -64.2 120.85 12.9 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.91 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.704 HG23 ' O ' ' A' ' 64' ' ' GLU . 0.2 OUTLIER 175.59 -171.82 0.07 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.116 179.952 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.834 ' O ' HG23 ' A' ' 74' ' ' THR . 4.1 t -178.27 169.17 1.87 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.923 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.413 ' O ' ' HB3' ' A' ' 68' ' ' ASP . 49.2 t80 -119.59 -52.95 2.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.959 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' ASP . . . . . 0.414 ' HB3' ' O ' ' A' ' 73' ' ' ASN . 17.6 t70 71.8 84.04 0.13 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.876 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.495 ' O ' ' CB ' ' A' ' 70' ' ' TYR . 0.0 OUTLIER -57.53 -170.61 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.903 179.914 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 70' ' ' TYR . . . . . 0.709 ' C ' HG22 ' A' ' 71' ' ' THR . 7.3 m-85 84.4 -4.2 1.03 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.05 -179.882 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.709 HG22 ' C ' ' A' ' 70' ' ' TYR . 0.0 OUTLIER 165.26 -26.22 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.2 -179.95 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 97.64 76.18 1.27 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.478 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ASN . . . . . 0.414 ' O ' ' HB3' ' A' ' 68' ' ' ASP . 2.6 m-20 -122.09 80.16 1.67 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.749 0.309 . . . . 0.0 110.96 179.954 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.834 HG23 ' O ' ' A' ' 66' ' ' CYS . 94.4 m -50.58 110.35 0.4 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.977 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.459 ' HB2' ' SG ' ' A' ' 94' ' ' CYS . 18.1 m-85 -108.68 164.08 12.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.646 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 4.2 mtt180 -78.83 117.37 19.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.952 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.46 ' HA ' ' O ' ' A' ' 94' ' ' CYS . 7.6 p -47.83 -22.69 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.191 -179.922 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -95.06 11.54 69.29 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.517 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -144.79 151.12 38.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.814 0.34 . . . . 0.0 110.962 179.961 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.982 HG22 HG23 ' A' ' 93' ' ' THR . 0.6 OUTLIER -96.72 -155.41 0.48 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.14 -179.921 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 81' ' ' TYR . . . . . 0.532 ' O ' ' CB ' ' A' ' 82' ' ' GLU . 9.6 p90 -172.02 -35.13 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.069 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.532 ' CB ' ' O ' ' A' ' 81' ' ' TYR . 0.7 OUTLIER 87.29 157.6 0.07 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.897 179.9 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 2.7 mtt-85 178.44 119.01 0.19 Allowed Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.849 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.73 167.62 25.17 Favored 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.748 2.299 . . . . 0.0 112.477 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.436 ' O ' ' N ' ' A' ' 87' ' ' SER . 0.0 OUTLIER -171.8 150.46 2.65 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.649 179.976 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 56.8 -85.04 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.886 -179.857 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 87' ' ' SER . . . . . 0.436 ' N ' ' O ' ' A' ' 85' ' ' LYS . 0.4 OUTLIER -159.71 23.18 0.18 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.952 179.848 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 88' ' ' MET . . . . . 0.409 ' O ' ' CD1' ' A' ' 90' ' ' TRP . 0.0 OUTLIER -148.85 146.1 27.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.971 -179.854 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 10.4 mt -90.83 134.44 29.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.986 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' TRP . . . . . 0.559 ' CH2' HD11 ' A' ' 106' ' ' ILE . 1.0 OUTLIER -125.44 144.55 50.47 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.038 -179.901 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 57.9 m-20 -80.04 67.68 5.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.658 179.748 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 23.1 m -55.09 124.62 17.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.035 -179.857 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.982 HG23 HG22 ' A' ' 80' ' ' THR . 2.0 m -117.87 113.96 22.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.977 179.819 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.555 ' HA ' HD12 ' A' ' 102' ' ' ILE . 0.0 OUTLIER -54.41 87.62 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.878 -179.81 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.467 HG13 ' O ' ' A' ' 93' ' ' THR . 2.3 mt -117.2 95.52 3.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.196 -179.925 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.414 ' HA3' ' HA2' ' A' ' 100' ' ' GLY . . . -145.98 -94.39 0.16 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.616 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.406 ' HB1' ' O ' ' A' ' 63' ' ' GLU . . . 62.68 41.18 9.47 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.846 0.355 . . . . 0.0 111.06 -179.867 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 139.21 -27.32 2.65 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.554 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.61 -31.71 3.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.841 0.353 . . . . 0.0 110.912 -179.986 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 0.414 ' HA2' ' HA3' ' A' ' 96' ' ' GLY . . . 60.36 50.71 64.65 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.548 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 6.0 ptp180 -99.18 54.83 0.98 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.787 0.327 . . . . 0.0 110.928 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.555 HD12 ' HA ' ' A' ' 94' ' ' CYS . 5.4 mm -37.3 126.71 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.244 -179.986 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 5.9 t -99.14 131.06 45.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.888 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 24.3 m -135.4 117.45 15.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.031 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 7.3 t -130.86 161.25 32.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.123 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.559 HD11 ' CH2' ' A' ' 90' ' ' TRP . 3.2 mp -82.89 121.21 35.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.091 179.911 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -49.68 140.73 10.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.149 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 65.0 t-20 -88.76 -34.85 16.97 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.869 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 109' ' ' ARG . . . . . 0.446 ' OXT' ' HG3' ' A' ' 109' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.947 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo . . . . . 0 C--O 1.232 0.2 0 CA-C-O 120.862 0.276 . . . . 0.0 112.3 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 96.66 -156.51 21.08 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.588 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 59.7 m -147.99 97.39 2.79 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.857 0.361 . . . . 0.0 110.847 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -64.97 150.03 48.72 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.826 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.466 ' OD1' ' O ' ' A' ' 26' ' ' LYS . 4.7 p-10 -133.86 -159.99 1.01 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.14 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.421 ' C ' ' O ' ' A' ' 23' ' ' ASP . 1.5 m-20 -34.45 -42.99 0.15 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.171 -179.816 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -173.15 32.11 0.11 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.598 -0.81 . . . . 0.0 112.611 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.592 ' HB3' ' CZ ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -139.93 134.92 32.26 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.815 0.34 . . . . 0.0 110.843 179.964 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 5.8 t-160 -114.21 86.77 2.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.892 -179.67 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.592 ' CZ ' ' HB3' ' A' ' 26' ' ' LYS . 1.6 m-85 -79.62 -168.96 1.74 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.0 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -105.92 165.53 11.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.792 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.702 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.1 mp -58.68 150.35 5.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.473 -179.772 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 67.5 m-80 61.04 13.34 4.56 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.118 179.785 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.405 ' O ' ' CZ3' ' A' ' 34' ' ' TRP . 12.4 tt0 -91.3 150.0 21.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.679 179.813 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.454 ' HG2' HG23 ' A' ' 46' ' ' THR . 11.8 mt-30 -114.41 145.02 42.37 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.137 -179.73 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' TRP . . . . . 0.585 ' CZ2' ' HB3' ' A' ' 45' ' ' CYS . 44.1 p90 -151.59 175.71 12.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.677 179.656 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -111.24 119.8 40.12 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.957 0.408 . . . . 0.0 111.455 -179.563 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.474 ' N ' ' O ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -110.7 -179.84 3.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.369 179.466 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.459 ' CG2' ' N ' ' A' ' 38' ' ' TYR . 1.0 OUTLIER -135.73 159.78 40.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.992 0.425 . . . . 0.0 110.975 -179.669 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.526 ' HB2' HD22 ' A' ' 43' ' ' LEU . 2.3 t80 -178.42 137.06 0.16 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.54 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.48 ' HA ' HD12 ' A' ' 39' ' ' LEU . 0.4 OUTLIER 59.04 27.55 16.52 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.613 -179.746 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 67.37 49.82 48.88 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.889 -0.672 . . . . 0.0 112.666 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 68.1 m-80 -152.52 167.14 29.79 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.818 0.342 . . . . 0.0 111.016 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.735 ' O ' HD12 ' A' ' 43' ' ' LEU . . . -86.54 131.46 34.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.75 179.693 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.735 HD12 ' O ' ' A' ' 42' ' ' ALA . 8.5 mp -127.85 155.45 44.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.319 -179.658 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.484 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 1.9 t -120.58 121.64 65.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.426 179.466 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.585 ' HB3' ' CZ2' ' A' ' 34' ' ' TRP . 1.3 m -106.99 163.29 13.1 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.281 -179.516 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.454 HG23 ' HG2' ' A' ' 33' ' ' GLN . 2.9 m -149.25 117.52 6.44 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.832 179.782 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.468 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 21.1 t -73.97 134.49 43.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.072 -179.811 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.542 ' CB ' ' HB3' ' A' ' 52' ' ' ARG . 6.8 m-85 -107.24 -29.7 9.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.863 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 100.27 168.0 29.07 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.451 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 48.99 -123.27 10.6 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.38 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -105.15 -4.53 21.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.764 0.316 . . . . 0.0 110.998 179.961 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.542 ' HB3' ' CB ' ' A' ' 48' ' ' TYR . 2.2 mtt85 -47.9 -28.16 2.51 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.905 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 60.13 146.7 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.592 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.564 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 22.9 p90 -74.96 177.7 6.13 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.732 0.301 . . . . 0.0 110.941 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -154.85 118.67 4.6 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.958 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.484 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.8 OUTLIER -103.08 150.74 23.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.874 179.942 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.445 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 0.3 OUTLIER -136.01 -86.08 0.35 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.906 -179.958 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.431 ' HA ' ' HA ' ' A' ' 43' ' ' LEU . 5.2 p -170.01 -166.05 0.53 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.96 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.437 ' HD2' ' C ' ' A' ' 59' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.878 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.567 ' O ' HG22 ' A' ' 65' ' ' THR . 1.8 tt0 . . . . . 0 N--CA 1.455 -0.176 0 CA-C-O 120.794 0.331 . . . . 0.0 110.505 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.439 ' C ' HG22 ' A' ' 65' ' ' THR . 5.4 tt0 54.07 58.36 5.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.829 -180.0 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.567 HG22 ' O ' ' A' ' 63' ' ' GLU . 0.2 OUTLIER -160.81 -176.44 5.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.007 -179.998 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.495 ' N ' ' OG1' ' A' ' 65' ' ' THR . 0.6 OUTLIER -171.72 175.8 3.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.924 179.913 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.467 ' CE1' ' HA ' ' A' ' 69' ' ' LYS . 20.0 t80 -165.21 110.13 0.9 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.833 -179.961 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' ASP . . . . . 0.559 ' O ' ' CD2' ' A' ' 70' ' ' TYR . 44.4 t0 -108.45 38.5 2.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.883 -179.947 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.584 ' HG3' ' CD1' ' A' ' 70' ' ' TYR . 4.3 ptmt 34.22 -154.13 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.078 179.988 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' TYR . . . . . 0.584 ' CD1' ' HG3' ' A' ' 69' ' ' LYS . 15.5 m-85 75.29 -54.22 0.65 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.949 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -138.47 -62.43 0.57 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.244 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 132.53 44.9 0.14 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.572 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -88.95 74.06 8.24 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.795 0.331 . . . . 0.0 111.011 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 33.7 m -45.87 107.88 0.11 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.927 0.394 . . . . 0.0 111.029 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 -85.47 -157.98 0.35 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.884 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' ARG . . . . . 0.433 ' HB2' ' HB2' ' A' ' 79' ' ' ASP . 16.2 mtm180 -143.53 135.62 26.77 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.779 179.857 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 52.9 t -43.9 -28.06 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.055 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -109.53 31.03 7.91 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.424 179.813 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ASP . . . . . 0.433 ' HB2' ' HB2' ' A' ' 76' ' ' ARG . 0.6 OUTLIER -128.47 106.21 8.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.845 0.355 . . . . 0.0 110.829 179.998 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.618 HG23 HG23 ' A' ' 93' ' ' THR . 0.0 OUTLIER -85.94 118.96 25.74 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.144 -179.974 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 81' ' ' TYR . . . . . 0.489 ' CZ ' ' HB3' ' A' ' 92' ' ' CYS . 30.1 p90 -120.06 173.87 6.83 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.753 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.446 ' HA ' ' O ' ' A' ' 90' ' ' TRP . 19.4 pt-20 -140.13 155.92 46.77 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.754 179.912 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.441 ' CZ ' ' HE2' ' A' ' 85' ' ' LYS . 0.0 OUTLIER -136.42 119.11 11.93 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.86 -179.929 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.66 95.09 0.62 Allowed 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.622 2.214 . . . . 0.0 112.242 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.441 ' HE2' ' CZ ' ' A' ' 83' ' ' ARG . 0.4 OUTLIER -146.81 163.76 34.99 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.905 -179.952 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 7.4 t0 56.21 49.51 15.23 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.832 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 9.3 m 43.54 31.17 0.4 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.923 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -159.18 175.56 13.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.892 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.458 ' O ' ' HA ' ' A' ' 106' ' ' ILE . 1.6 mp -126.27 134.17 67.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.158 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 90' ' ' TRP . . . . . 0.618 ' CD1' ' N ' ' A' ' 90' ' ' TRP . 0.0 OUTLIER -130.08 124.93 33.96 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.837 179.956 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.408 ' C ' ' O ' ' A' ' 81' ' ' TYR . 0.3 OUTLIER -78.93 71.14 5.37 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.993 -179.89 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 92' ' ' CYS . . . . . 0.489 ' HB3' ' CZ ' ' A' ' 81' ' ' TYR . 0.5 OUTLIER -45.97 136.42 6.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.895 179.808 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.618 HG23 HG23 ' A' ' 80' ' ' THR . 7.2 m -115.34 122.21 45.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.164 -179.906 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.452 ' SG ' ' O ' ' A' ' 96' ' ' GLY . 28.5 t -67.62 69.84 0.11 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.718 179.951 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -70.3 -7.88 9.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.408 -179.753 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.477 ' HA3' ' HA3' ' A' ' 100' ' ' GLY . . . -132.15 -165.6 11.35 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.55 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.419 ' HA ' ' O ' ' A' ' 65' ' ' THR . . . -140.3 -41.29 0.42 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.919 0.39 . . . . 0.0 110.927 179.912 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -152.88 17.42 0.73 Allowed Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.322 179.842 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 170.8 36.97 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.784 0.325 . . . . 0.0 110.957 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 0.477 ' HA3' ' HA3' ' A' ' 96' ' ' GLY . . . -97.8 -97.18 1.98 Allowed Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.563 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.496 ' O ' ' CG ' ' A' ' 101' ' ' ARG . 0.0 OUTLIER 170.55 75.17 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.792 0.33 . . . . 0.0 110.921 179.924 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 18.8 mt -58.14 79.55 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.085 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.481 ' N ' ' O ' ' A' ' 101' ' ' ARG . 9.6 t -58.65 167.82 1.38 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.033 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.415 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 0.0 OUTLIER -146.8 104.95 3.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.774 179.937 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 2.8 t -118.55 135.31 54.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.117 -179.896 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.48 ' HA ' ' HA ' ' A' ' 90' ' ' TRP . 2.4 mp -60.2 142.3 15.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.914 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -132.95 107.31 8.21 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.052 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 108' ' ' ASN . . . . . 0.417 ' O ' ' C ' ' A' ' 109' ' ' ARG . 32.0 t-20 -112.13 129.81 56.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.998 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 109' ' ' ARG . . . . . 0.417 ' C ' ' O ' ' A' ' 108' ' ' ASN . 1.0 OUTLIER . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.155 -0.926 . . . . 0.0 110.852 179.959 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo . . . . . 0 N--CA 1.464 -0.253 0 CA-C-O 120.841 0.267 . . . . 0.0 112.418 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 126.89 171.88 13.17 Favored Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.762 -0.733 . . . . 0.0 112.512 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 50.6 m -112.19 85.66 2.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.781 0.325 . . . . 0.0 110.793 -179.981 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -74.78 124.05 26.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.0 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.425 ' O ' ' CG ' ' A' ' 24' ' ' ASN . 0.3 OUTLIER -167.91 147.6 4.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.889 179.897 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.429 ' ND2' ' HB2' ' A' ' 26' ' ' LYS . 8.0 p-10 46.02 53.41 9.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.934 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 53.92 20.27 13.22 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.541 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.589 ' HB3' ' CZ ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -125.83 133.74 51.88 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.807 0.337 . . . . 0.0 111.004 -179.996 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 4.0 t-160 -117.97 84.18 2.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.956 -179.915 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.589 ' CZ ' ' HB3' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -79.91 167.88 19.95 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.79 179.906 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.483 ' O ' ' HB2' ' A' ' 32' ' ' GLN . 8.5 mt-30 -93.12 170.7 9.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.786 179.808 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.719 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.0 mp -65.49 153.74 8.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.338 -179.909 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 84.6 m-20 55.01 17.69 1.97 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.089 179.8 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.483 ' HB2' ' O ' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -97.1 139.26 33.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.816 179.809 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 11.7 mt-30 -107.01 148.66 28.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.872 -179.801 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' TRP . . . . . 0.534 ' CE2' ' CE1' ' A' ' 28' ' ' TYR . 38.8 p90 -165.75 -167.41 1.1 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.902 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.404 ' OE2' ' HE2' ' A' ' 59' ' ' LYS . 8.5 mt-10 -119.18 125.25 48.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.067 -179.786 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.481 ' O ' HD22 ' A' ' 43' ' ' LEU . 0.4 OUTLIER -121.6 123.39 41.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.55 179.714 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.483 ' HA ' ' O ' ' A' ' 41' ' ' ASN . 1.3 m -99.89 136.27 40.05 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.828 -179.565 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.812 ' CE1' HD13 ' A' ' 39' ' ' LEU . 5.8 t80 -152.04 142.76 22.86 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.707 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.812 HD13 ' CE1' ' A' ' 38' ' ' TYR . 0.0 OUTLIER 53.37 41.4 32.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.674 -179.761 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 60.3 50.56 66.3 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.521 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.483 ' O ' ' HA ' ' A' ' 37' ' ' THR . 60.0 m-80 -154.37 154.11 32.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.706 0.288 . . . . 0.0 111.024 179.993 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 1.019 ' C ' HD13 ' A' ' 43' ' ' LEU . . . -100.46 111.12 23.34 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.91 179.882 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 1.019 HD13 ' C ' ' A' ' 42' ' ' ALA . 0.0 OUTLIER -119.94 131.4 55.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.385 -179.631 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.505 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.4 t -77.83 128.61 38.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 178.762 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.561 ' SG ' ' CE1' ' A' ' 54' ' ' PHE . 1.5 m -110.1 144.19 39.07 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.014 0.435 . . . . 0.0 111.592 -179.151 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.449 ' O ' ' CD1' ' A' ' 48' ' ' TYR . 29.3 m -134.53 110.42 9.34 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.764 179.442 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.44 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 15.2 t -67.54 138.31 56.4 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.954 -179.691 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.526 ' O ' ' CG2' ' A' ' 30' ' ' ILE . 2.0 m-85 -105.38 -51.85 2.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.958 179.984 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 128.27 -179.69 16.4 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.427 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 41.15 -121.45 2.09 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.452 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -108.29 2.48 22.67 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.667 0.27 . . . . 0.0 111.093 -179.989 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.425 ' O ' ' O ' ' A' ' 53' ' ' GLY . 61.5 mtt180 -59.24 -42.09 90.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.944 179.986 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' GLY . . . . . 0.425 ' O ' ' O ' ' A' ' 52' ' ' ARG . . . 59.04 143.71 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.431 -179.921 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.561 ' CE1' ' SG ' ' A' ' 45' ' ' CYS . 1.3 p90 -58.03 150.28 21.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.943 0.401 . . . . 0.0 110.947 -179.926 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -104.46 -33.96 8.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.652 179.869 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.505 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.1 OUTLIER 59.27 148.29 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.051 179.864 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -130.08 -88.9 0.49 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.963 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.475 ' HA ' ' HA ' ' A' ' 43' ' ' LEU . 0.4 OUTLIER -158.0 -162.96 1.22 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.874 -179.967 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.404 ' HE2' ' OE2' ' A' ' 35' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.217 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.974 -179.918 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.441 ' CD ' ' CG2' ' A' ' 65' ' ' THR . 0.2 OUTLIER . . . . . 0 N--CA 1.447 -0.602 0 CA-C-O 120.81 0.338 . . . . 0.0 111.134 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 46.83 62.35 2.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.904 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.441 ' CG2' ' CD ' ' A' ' 63' ' ' GLU . 7.3 t -178.31 -160.11 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.189 -179.931 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.617 ' O ' HG23 ' A' ' 74' ' ' THR . 2.0 p -175.63 -178.0 1.04 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.869 -179.94 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -136.94 107.1 6.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.976 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' ASP . . . . . 0.498 ' O ' ' N ' ' A' ' 72' ' ' GLY . 12.2 t70 -78.29 67.02 4.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.745 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.402 ' HG3' ' CD1' ' A' ' 70' ' ' TYR . 10.9 ptmt -41.27 -32.16 0.27 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.026 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' TYR . . . . . 0.458 ' CD1' ' N ' ' A' ' 70' ' ' TYR . 1.7 m-30 -57.17 -33.13 67.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.858 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 3.9 m -126.46 -43.24 1.76 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.175 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' GLY . . . . . 0.498 ' N ' ' O ' ' A' ' 68' ' ' ASP . . . 111.37 1.61 27.89 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.476 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -89.22 111.69 22.55 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.731 0.3 . . . . 0.0 110.892 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.617 HG23 ' O ' ' A' ' 66' ' ' CYS . 55.5 m -64.81 128.67 36.73 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.018 179.878 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.448 ' CE2' ' HB2' ' A' ' 68' ' ' ASP . 27.7 m-85 -116.19 -171.65 2.03 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.769 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 5.7 ttt180 -103.24 129.97 50.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.808 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.441 ' HA ' ' O ' ' A' ' 94' ' ' CYS . 14.0 p -49.44 -36.63 10.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.211 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -78.2 5.92 52.7 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.525 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.17 119.44 37.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.854 0.359 . . . . 0.0 110.961 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -94.83 146.91 23.88 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.165 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' TYR . . . . . 0.468 ' CE2' ' OD1' ' A' ' 68' ' ' ASP . 3.0 p90 -146.86 121.84 10.04 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.91 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.13 148.91 25.88 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.814 179.883 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.414 ' O ' ' HG2' ' A' ' 85' ' ' LYS . 0.0 OUTLIER -152.52 118.63 3.03 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.002 179.963 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.433 ' HA ' ' HA ' ' A' ' 89' ' ' ILE . 50.5 Cg_exo -53.81 85.93 0.03 OUTLIER 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 122.706 2.271 . . . . 0.0 112.22 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.452 ' O ' ' N ' ' A' ' 87' ' ' SER . 8.4 mmtm -87.59 160.94 18.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.976 -179.839 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 49.7 m-20 45.37 -92.02 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.022 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' SER . . . . . 0.452 ' N ' ' O ' ' A' ' 85' ' ' LYS . 1.4 m -143.83 20.65 1.81 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.963 -179.935 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 10.6 ttm -152.03 173.33 15.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.795 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.451 ' O ' ' HA ' ' A' ' 106' ' ' ILE . 1.8 mt -101.22 125.95 55.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.143 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 90' ' ' TRP . . . . . 0.622 ' CD1' ' N ' ' A' ' 90' ' ' TRP . 0.2 OUTLIER -126.14 130.29 50.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.854 -179.937 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.46 ' N ' ' O ' ' A' ' 105' ' ' THR . 24.7 t0 -65.59 63.61 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.838 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 92' ' ' CYS . . . . . 0.47 ' HA ' ' HA ' ' A' ' 104' ' ' CYS . 8.3 m -51.13 93.38 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.991 -179.91 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.475 ' N ' ' O ' ' A' ' 103' ' ' SER . 0.2 OUTLIER -82.9 130.26 35.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.021 179.936 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.441 ' O ' ' HA ' ' A' ' 77' ' ' VAL . 0.7 OUTLIER -75.91 56.89 1.0 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.997 -179.847 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.466 HG13 ' HB ' ' A' ' 93' ' ' THR . 2.0 mt -73.54 72.62 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.12 179.96 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -127.74 84.29 0.33 Allowed Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.563 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -121.99 80.71 1.73 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.852 0.358 . . . . 0.0 111.054 179.909 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 113.72 6.75 20.94 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.398 -179.835 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -164.86 -60.55 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.837 0.351 . . . . 0.0 110.854 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 114.45 80.19 0.91 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.475 -179.949 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.92 102.53 7.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.791 0.329 . . . . 0.0 110.942 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.57 ' N ' HD13 ' A' ' 102' ' ' ILE . 2.5 mm -85.1 76.36 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.159 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.475 ' O ' ' N ' ' A' ' 93' ' ' THR . 3.3 t -63.24 135.51 57.13 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.935 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.47 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 39.4 m -124.73 152.63 43.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.818 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 105' ' ' THR . . . . . 0.46 ' O ' ' N ' ' A' ' 91' ' ' ASP . 2.7 t -162.11 141.28 9.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.157 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.451 ' HA ' ' O ' ' A' ' 89' ' ' ILE . 0.8 OUTLIER -68.06 149.0 11.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.064 179.846 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -156.87 136.71 12.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.154 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -112.34 114.55 27.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.959 -179.915 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 11.0 mmt180 . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.153 -0.927 . . . . 0.0 110.899 179.856 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo . . . . . 0 N--CA 1.464 -0.248 0 CA-C-O 120.756 0.232 . . . . 0.0 112.436 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 119.82 168.44 13.86 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.706 179.958 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 98.0 m -118.42 109.85 16.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.806 0.336 . . . . 0.0 110.84 179.924 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 79.5 t80 -96.67 116.32 28.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.954 -179.904 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -159.22 153.51 23.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.885 -179.971 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.427 ' CG ' ' O ' ' A' ' 24' ' ' ASN . 23.7 t-20 55.89 33.65 22.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.896 179.998 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 68.42 12.8 64.29 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.555 -179.982 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.483 ' HB3' ' CE1' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -123.07 140.57 52.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.834 0.35 . . . . 0.0 110.918 179.983 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 5.6 t-160 -116.1 91.86 3.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.003 -179.826 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.582 ' CE2' ' CE2' ' A' ' 34' ' ' TRP . 0.1 OUTLIER -81.2 -179.2 7.25 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.019 179.932 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.519 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 0.0 OUTLIER -110.42 145.08 38.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.835 179.946 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.668 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.7 mp -41.26 148.27 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.395 -179.898 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.423 ' HB2' ' O ' ' A' ' 30' ' ' ILE . 71.5 m-80 66.63 12.92 9.09 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.136 179.801 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.519 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 56.1 tt0 -101.67 155.62 18.0 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.014 0.435 . . . . 0.0 111.23 -179.973 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.485 ' HG2' ' OG1' ' A' ' 46' ' ' THR . 23.2 mt-30 -119.34 158.83 25.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.632 179.944 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 34' ' ' TRP . . . . . 0.585 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 43.8 p90 -162.95 176.07 10.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.03 -179.964 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -107.11 113.69 27.3 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.087 -179.872 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.517 ' N ' ' O ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -97.48 178.18 5.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.805 179.92 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -147.39 140.58 25.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.667 -179.796 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 11.7 t80 -160.12 140.07 11.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.729 179.808 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 57.0 23.85 8.82 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.784 -179.879 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 75.52 32.86 53.95 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.888 -0.673 . . . . 0.0 112.747 179.819 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.454 ' O ' HD13 ' A' ' 43' ' ' LEU . 91.0 m-20 -136.38 148.36 47.79 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 120.875 0.369 . . . . 0.0 110.984 179.796 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.612 ' O ' HD12 ' A' ' 43' ' ' LEU . . . -71.65 133.82 45.94 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.767 179.841 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.612 HD12 ' O ' ' A' ' 42' ' ' ALA . 10.0 mp -126.44 153.34 45.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.358 -179.649 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.469 ' O ' ' HB3' ' A' ' 56' ' ' CYS . 2.2 t -113.02 124.14 69.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.026 -0.534 . . . . 0.0 109.904 179.033 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.585 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 9.4 m -113.28 161.71 16.89 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.902 -178.838 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.485 ' OG1' ' HG2' ' A' ' 33' ' ' GLN . 55.2 m -151.63 109.87 3.74 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.664 179.638 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.555 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 16.9 t -66.83 145.22 55.72 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.971 -179.765 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.484 ' CE1' ' O ' ' A' ' 46' ' ' THR . 4.0 m-85 -115.47 -42.51 3.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.852 -179.956 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 149.32 41.16 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.422 -179.901 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 49.42 47.49 35.6 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.487 -179.958 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 71.1 p -156.04 -58.9 0.1 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.841 0.353 . . . . 0.0 110.785 -179.977 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 13.7 mtp180 -75.96 1.17 16.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.078 179.984 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 62.35 116.89 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.743 -0.742 . . . . 0.0 112.519 179.948 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.567 ' CG ' ' O ' ' A' ' 54' ' ' PHE . 15.1 p90 -56.47 99.03 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.832 0.348 . . . . 0.0 110.836 179.976 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -72.45 140.56 48.36 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.955 -179.919 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.496 ' SG ' ' CD2' ' A' ' 54' ' ' PHE . 2.3 m -145.99 175.18 10.64 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.933 -179.916 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -171.03 -174.17 1.46 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.918 -179.95 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.414 ' O ' ' C ' ' A' ' 59' ' ' LYS . 5.0 p -79.77 136.24 36.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.876 179.993 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.414 ' C ' ' O ' ' A' ' 58' ' ' SER . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.902 -179.927 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.455 -0.219 0 CA-C-O 120.843 0.354 . . . . 0.0 110.697 . . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.481 ' C ' HG22 ' A' ' 65' ' ' THR . 3.0 tt0 -73.62 88.09 1.68 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.887 -179.888 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.496 ' OG1' ' N ' ' A' ' 66' ' ' CYS . 0.5 OUTLIER -168.58 176.63 5.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.079 179.918 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.496 ' N ' ' OG1' ' A' ' 65' ' ' THR . 0.1 OUTLIER 177.53 -66.07 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.923 -179.949 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.438 ' O ' ' N ' ' A' ' 69' ' ' LYS . 46.2 t80 63.28 74.82 0.41 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.951 179.935 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 68' ' ' ASP . . . . . 0.514 ' O ' ' N ' ' A' ' 72' ' ' GLY . 15.0 t70 -41.27 95.19 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.85 179.982 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.438 ' N ' ' O ' ' A' ' 67' ' ' PHE . 2.2 pttm -57.11 -17.41 10.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.916 -179.926 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -65.84 -56.27 12.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.102 -179.866 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.99 7.04 14.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.277 -179.904 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 72' ' ' GLY . . . . . 0.514 ' N ' ' O ' ' A' ' 68' ' ' ASP . . . 59.77 31.62 72.15 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.382 179.947 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -84.05 -172.96 4.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.852 0.358 . . . . 0.0 110.773 179.93 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 15.8 m -111.03 79.06 1.16 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.968 179.925 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.456 ' CD2' ' HB2' ' A' ' 68' ' ' ASP . 11.1 m-30 -89.46 169.56 11.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.893 -179.99 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 76' ' ' ARG . . . . . 0.426 ' NE ' ' OE2' ' A' ' 64' ' ' GLU . 0.0 OUTLIER -128.01 135.97 50.63 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.766 -179.966 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.454 ' HA ' ' O ' ' A' ' 94' ' ' CYS . 2.3 p -48.53 -26.53 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.945 -179.965 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -90.1 8.25 80.14 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.513 -179.955 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -125.43 127.51 46.64 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.849 0.357 . . . . 0.0 110.787 179.966 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 5.0 t -103.35 150.8 23.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.148 -179.874 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 81' ' ' TYR . . . . . 0.498 ' CG ' ' O ' ' A' ' 81' ' ' TYR . 25.9 p90 -140.84 112.09 7.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.824 179.844 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.486 ' CB ' ' OD1' ' A' ' 91' ' ' ASP . 6.1 pt-20 -86.12 136.12 33.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.974 -179.835 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.442 ' HA ' ' HD2' ' A' ' 84' ' ' PRO . 4.4 mtt180 -110.59 106.79 58.04 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.815 -179.991 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.451 ' HA ' HG12 ' A' ' 89' ' ' ILE . 34.0 Cg_endo -64.62 88.35 0.17 Allowed 'Trans proline' 0 C--O 1.231 0.156 0 C-N-CA 122.784 2.323 . . . . 0.0 112.283 179.983 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 2.4 mttm -126.74 126.32 43.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.934 179.995 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.491 ' CB ' ' SD ' ' A' ' 88' ' ' MET . 0.4 OUTLIER 67.92 177.42 0.25 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.841 179.905 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.2 m -84.99 55.58 3.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.945 -179.987 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 88' ' ' MET . . . . . 0.491 ' SD ' ' CB ' ' A' ' 86' ' ' ASP . 0.0 OUTLIER -150.23 -47.41 0.13 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.83 -179.947 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.484 ' C ' ' CD1' ' A' ' 90' ' ' TRP . 35.6 mt 62.76 137.4 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.839 179.97 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 90' ' ' TRP . . . . . 0.604 ' CD1' ' N ' ' A' ' 90' ' ' TRP . 0.1 OUTLIER -142.67 124.55 15.16 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.934 -179.881 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.486 ' OD1' ' CB ' ' A' ' 82' ' ' GLU . 93.8 m-20 -75.21 72.89 2.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.939 179.983 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 92' ' ' CYS . . . . . 0.476 ' HA ' ' O ' ' A' ' 103' ' ' SER . 0.1 OUTLIER -52.34 99.19 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.956 179.879 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 2.5 m -80.88 127.92 33.09 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.008 179.903 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.672 ' HA ' HD12 ' A' ' 102' ' ' ILE . 1.8 t -70.49 72.55 0.5 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.989 -179.856 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 1.9 mt -67.99 149.12 11.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.162 179.97 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -159.92 -102.82 0.18 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.644 -179.947 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . 48.69 37.78 10.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.836 0.351 . . . . 0.0 111.019 -179.914 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 120.43 -38.42 2.74 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.506 179.999 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.22 99.78 6.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.769 0.318 . . . . 0.0 110.882 -179.926 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -69.96 77.62 0.41 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.433 179.93 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -120.8 93.73 4.12 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.805 0.336 . . . . 0.0 110.961 -179.983 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.672 HD12 ' HA ' ' A' ' 94' ' ' CYS . 6.6 mm -60.75 123.91 14.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.124 179.906 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.476 ' O ' ' HA ' ' A' ' 92' ' ' CYS . 25.3 t -105.93 125.81 51.44 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.991 -179.92 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.45 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 0.5 OUTLIER -102.27 86.5 2.84 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.962 -179.924 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 4.7 t -73.12 131.75 42.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.113 179.918 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.575 ' HB ' ' CZ3' ' A' ' 90' ' ' TRP . 0.9 OUTLIER -62.87 148.78 10.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.959 179.794 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.451 ' HB3' ' O ' ' A' ' 88' ' ' MET . . . -77.6 168.52 19.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.019 179.941 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -175.54 145.1 0.71 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.891 -179.961 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 4.1 mtt180 . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.855 -179.98 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_exo . . . . . 0 C--O 1.232 0.178 0 CA-C-O 120.755 0.231 . . . . 0.0 112.256 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 20' ' ' GLY . . . . . 0.527 ' H ' HD11 ' A' ' 30' ' ' ILE . . . 82.33 122.87 0.72 Allowed Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.572 179.947 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.483 ' O ' ' HB2' ' A' ' 22' ' ' TYR . 11.7 m -79.49 -179.91 7.09 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.83 0.347 . . . . 0.0 110.752 179.781 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.483 ' HB2' ' O ' ' A' ' 21' ' ' CYS . 85.7 t80 174.93 119.35 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.919 179.942 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -153.95 156.89 38.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.856 -179.996 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.4 ' CG ' ' O ' ' A' ' 24' ' ' ASN . 29.3 t-20 48.35 27.47 1.37 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.88 -179.943 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.06 -3.55 70.56 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.523 179.965 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.586 ' HB3' ' CZ ' ' A' ' 28' ' ' TYR . 0.9 OUTLIER -91.95 135.52 33.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.837 0.351 . . . . 0.0 110.852 -179.986 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 3.9 t-160 -113.47 90.82 3.44 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.997 -179.984 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.586 ' CZ ' ' HB3' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -84.98 142.61 29.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.988 179.938 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.526 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 20.2 mt-30 -76.39 147.0 38.32 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.587 179.771 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.828 HD13 ' SG ' ' A' ' 47' ' ' CYS . 7.6 mm -49.5 147.59 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.961 0.41 . . . . 0.0 110.982 179.979 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.431 ' CG ' HG22 ' A' ' 30' ' ' ILE . 61.3 m-20 67.1 7.77 5.67 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.042 179.956 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.526 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 1.5 tt0 -92.76 151.79 19.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.849 0.356 . . . . 0.0 110.9 179.932 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -124.8 136.54 53.92 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.043 -179.826 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 34' ' ' TRP . . . . . 0.595 ' CZ3' ' HB2' ' A' ' 47' ' ' CYS . 19.3 p90 -134.86 -170.96 2.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.759 179.876 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.5 ' HG3' HG22 ' A' ' 44' ' ' VAL . 2.2 mt-10 -130.76 125.17 33.12 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.922 0.391 . . . . 0.0 111.159 -179.868 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.47 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 0.1 OUTLIER -122.85 172.89 8.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.74 179.742 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -126.37 143.94 51.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.757 -179.769 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -155.92 125.45 6.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.611 179.769 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 74.36 14.61 3.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.522 -179.879 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 80.01 45.49 8.27 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.611 -179.957 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 9.1 m120 -149.46 168.33 23.74 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 120.789 0.328 . . . . 0.0 110.995 179.865 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.783 ' C ' HD12 ' A' ' 43' ' ' LEU . . . -82.82 132.08 35.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.953 179.805 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.783 HD12 ' C ' ' A' ' 42' ' ' ALA . 10.3 mp -136.52 146.28 46.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.972 0.415 . . . . 0.0 111.311 -179.718 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.5 HG22 ' HG3' ' A' ' 35' ' ' GLU . 2.4 t -114.74 130.6 68.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.139 179.05 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.593 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 1.3 m -112.06 166.54 11.15 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.096 0.474 . . . . 0.0 111.537 -179.323 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.467 ' O ' ' HB2' ' A' ' 54' ' ' PHE . 27.9 m -143.52 147.56 34.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.663 -0.698 . . . . 0.0 110.69 179.704 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.828 ' SG ' HD13 ' A' ' 30' ' ' ILE . 21.9 t -106.88 143.91 34.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.937 -179.825 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.44 ' CD1' ' N ' ' A' ' 48' ' ' TYR . 3.1 m-85 -130.37 -47.08 1.08 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.919 179.906 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 99.91 -50.22 1.12 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.793 -0.718 . . . . 0.0 112.428 -179.921 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -70.46 -152.88 0.91 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.486 179.913 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.12 -6.14 45.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.7 0.286 . . . . 0.0 111.016 179.986 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 1.3 mtt180 -62.68 -38.25 89.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.106 -179.932 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 61.42 155.82 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.657 -0.782 . . . . 0.0 112.303 -179.887 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.558 ' CE1' ' SG ' ' A' ' 45' ' ' CYS . 0.2 OUTLIER -72.88 126.59 30.29 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.794 0.33 . . . . 0.0 110.818 -179.966 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 43.9 m-80 -120.47 118.27 29.84 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.767 179.97 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.49 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.1 OUTLIER -89.28 167.27 13.2 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.061 -179.837 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -151.24 151.04 31.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.836 179.938 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.462 ' O ' ' O ' ' A' ' 59' ' ' LYS . 4.9 p -72.19 77.94 0.97 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.968 -179.933 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.462 ' O ' ' O ' ' A' ' 58' ' ' SER . 12.3 tptt . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.048 179.883 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.454 -0.256 0 CA-C-O 120.783 0.325 . . . . 0.0 110.481 . . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.507 ' HB3' HG11 ' A' ' 77' ' ' VAL . 1.8 mp0 -151.53 122.31 7.52 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.964 -179.866 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.459 ' O ' ' HA3' ' A' ' 96' ' ' GLY . 0.0 OUTLIER -173.91 -172.01 0.69 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.0 179.96 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.459 ' O ' HG23 ' A' ' 74' ' ' THR . 1.7 p -171.5 171.47 5.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.961 179.959 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -160.6 106.74 1.49 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.027 179.998 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 50.2 t0 -70.44 88.05 0.65 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.825 179.965 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.426 ' O ' ' C ' ' A' ' 70' ' ' TYR . 0.5 OUTLIER -59.35 -37.44 77.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.997 -179.975 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 70' ' ' TYR . . . . . 0.426 ' C ' ' O ' ' A' ' 69' ' ' LYS . 10.5 m-30 -36.13 -40.57 0.22 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.863 179.949 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 91.2 m -121.58 -30.45 4.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.138 179.88 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 107.18 14.14 19.39 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.37 -179.924 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 15.4 m-20 -92.73 176.81 6.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.923 0.392 . . . . 0.0 110.967 179.981 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.459 HG23 ' O ' ' A' ' 66' ' ' CYS . 90.0 m -132.85 136.41 46.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.959 179.88 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.459 ' CD2' ' CE2' ' A' ' 81' ' ' TYR . 34.7 m-85 -128.38 -170.72 2.3 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.74 -179.972 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 31.1 mtt-85 -99.18 124.52 44.3 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.808 179.921 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.507 HG11 ' HB3' ' A' ' 64' ' ' GLU . 7.3 p -54.0 -27.27 15.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.169 -179.93 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -79.83 -4.99 89.63 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.578 -179.979 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -123.17 -174.52 2.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.833 0.349 . . . . 0.0 110.98 -179.989 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 13.6 t -144.63 -174.68 4.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.979 -179.98 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 81' ' ' TYR . . . . . 0.459 ' CE2' ' CD2' ' A' ' 75' ' ' TYR . 33.3 p90 -159.92 153.85 23.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.952 179.963 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 54.4 tt0 -82.88 140.77 32.69 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.875 179.98 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.43 110.43 9.7 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.971 -179.883 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -74.32 98.36 1.1 Allowed 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 122.736 2.291 . . . . 0.0 112.381 179.977 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.402 ' O ' ' CB ' ' A' ' 86' ' ' ASP . 0.1 OUTLIER -131.55 123.26 27.59 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.91 -179.993 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.402 ' CB ' ' O ' ' A' ' 85' ' ' LYS . 2.6 t0 77.31 -155.18 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.924 179.954 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 59.3 p -85.26 -3.24 58.75 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.125 179.925 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 2.7 tpt -128.09 163.91 23.58 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.889 -179.949 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.514 ' C ' ' CD1' ' A' ' 90' ' ' TRP . 2.3 mp -106.23 152.45 7.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.052 179.88 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 90' ' ' TRP . . . . . 0.618 ' CD1' ' N ' ' A' ' 90' ' ' TRP . 0.1 OUTLIER -143.81 141.81 30.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.963 -179.986 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -91.34 70.85 6.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.924 179.963 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 92' ' ' CYS . . . . . 0.426 ' HA ' ' HA ' ' A' ' 104' ' ' CYS . 72.1 m -47.9 99.95 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.039 -179.958 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.513 ' O ' HG23 ' A' ' 102' ' ' ILE . 0.2 OUTLIER -71.26 122.29 19.97 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.879 179.896 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -63.76 86.47 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.938 -179.84 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.833 HG22 ' CA ' ' A' ' 100' ' ' GLY . 1.1 mt -100.0 102.11 13.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.147 -179.948 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 96' ' ' GLY . . . . . 0.624 ' O ' ' HB3' ' A' ' 97' ' ' ALA . . . -112.08 -136.53 6.86 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.706 -179.969 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.624 ' HB3' ' O ' ' A' ' 96' ' ' GLY . . . 79.76 -157.46 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.632 0.253 . . . . 0.0 110.875 -179.776 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -42.36 -30.83 0.87 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.515 -0.85 . . . . 0.0 112.204 179.871 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.51 ' O ' ' N ' ' A' ' 101' ' ' ARG . 3.9 ttp180 -155.69 -55.03 0.09 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.846 0.355 . . . . 0.0 110.377 179.824 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 0.833 ' CA ' HG22 ' A' ' 95' ' ' ILE . . . 58.14 -75.22 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.952 -0.642 . . . . 0.0 112.779 179.667 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.521 ' CD ' ' O ' ' A' ' 101' ' ' ARG . 0.0 OUTLIER 69.11 87.07 0.12 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.831 0.348 . . . . 0.0 110.494 -179.733 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.599 ' H ' HD12 ' A' ' 102' ' ' ILE . 3.7 mp -41.2 122.13 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.18 179.96 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.475 ' HB2' ' NH2' ' A' ' 101' ' ' ARG . 19.5 t -105.38 133.01 50.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.929 -179.913 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.426 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 38.3 m -112.32 132.1 55.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.883 179.902 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 105' ' ' THR . . . . . 0.412 ' O ' ' HA ' ' A' ' 90' ' ' TRP . 5.0 t -140.72 143.67 35.14 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.216 -179.931 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.466 ' HA ' ' O ' ' A' ' 89' ' ' ILE . 5.8 mt -47.91 155.24 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.902 179.919 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.429 ' N ' ' CG2' ' A' ' 106' ' ' ILE . . . -90.59 111.95 23.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.059 -179.99 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -92.65 154.52 18.32 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.863 -179.941 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 15.1 ptt85 . . . . . 0 C--O 1.248 0.985 0 CA-C-O 118.273 -0.87 . . . . 0.0 110.875 -179.919 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.433 ' HB2' HD11 ' A' ' 30' ' ' ILE . 32.5 Cg_exo . . . . . 0 C--O 1.231 0.132 0 CA-C-O 120.854 0.273 . . . . 0.0 112.178 . . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 152.18 -162.06 29.64 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.514 -179.976 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 17.1 m -152.67 97.92 2.29 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.916 0.388 . . . . 0.0 110.819 179.979 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -71.83 135.21 46.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.982 -179.986 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.411 ' HB3' ' ND2' ' A' ' 24' ' ' ASN . 0.2 OUTLIER -157.48 121.98 4.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.95 179.995 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.411 ' ND2' ' HB3' ' A' ' 23' ' ' ASP . 3.1 p30 44.62 47.42 8.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.048 179.934 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 71.11 2.17 45.79 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.638 179.924 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.403 ' HB3' ' CZ ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -103.26 133.33 48.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.834 0.349 . . . . 0.0 110.906 179.961 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -116.73 91.94 3.73 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.963 -179.769 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.598 ' CE2' ' CE2' ' A' ' 34' ' ' TRP . 3.2 m-85 -79.79 130.52 35.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.946 -179.955 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.47 ' O ' ' HB2' ' A' ' 32' ' ' GLN . 3.2 tt0 -63.25 135.05 56.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.599 179.891 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.717 HG23 ' C ' ' A' ' 48' ' ' TYR . 4.2 mp -31.85 139.07 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.512 -179.924 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.476 ' N ' ' O ' ' A' ' 47' ' ' CYS . 61.0 m-20 78.11 0.74 2.72 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.124 -179.78 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.47 ' HB2' ' O ' ' A' ' 29' ' ' GLN . 6.3 mm100 -76.94 141.71 40.36 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.819 0.342 . . . . 0.0 110.885 179.81 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 33' ' ' GLN . . . . . 0.487 ' HG2' HG23 ' A' ' 46' ' ' THR . 11.4 mt-30 -114.13 132.33 56.1 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.037 -179.962 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 34' ' ' TRP . . . . . 0.598 ' CE2' ' CE2' ' A' ' 28' ' ' TYR . 42.6 p90 -148.61 -168.46 3.1 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.921 -179.935 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -122.44 132.78 54.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.967 -179.799 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 1.0 ' O ' HD22 ' A' ' 43' ' ' LEU . 0.4 OUTLIER -119.95 167.56 12.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.773 179.879 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.776 HG22 ' O ' ' A' ' 41' ' ' ASN . 0.1 OUTLIER -109.43 164.23 12.69 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.086 -179.86 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.582 ' HB2' HD21 ' A' ' 43' ' ' LEU . 0.1 OUTLIER -156.14 93.01 1.39 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.651 179.91 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.45 HD13 ' HA ' ' A' ' 39' ' ' LEU . 0.8 OUTLIER 67.2 18.59 10.36 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.694 -179.707 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 107.11 8.97 30.67 Favored Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.62 179.996 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.776 ' O ' HG22 ' A' ' 37' ' ' THR . 50.1 m-80 -94.78 -173.11 2.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.852 0.358 . . . . 0.0 111.018 -179.908 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.957 ' C ' HD13 ' A' ' 43' ' ' LEU . . . -135.48 107.83 7.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.924 179.844 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 1.0 HD22 ' O ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -121.89 157.59 30.85 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.156 -179.889 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.467 ' O ' ' HB3' ' A' ' 56' ' ' CYS . 2.8 t -95.8 132.09 40.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.176 -0.466 . . . . 0.0 109.934 179.122 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.54 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 1.8 m -114.29 157.17 23.12 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.738 -179.092 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.487 HG23 ' HG2' ' A' ' 33' ' ' GLN . 4.6 m -146.18 130.81 17.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.599 179.545 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.51 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 20.0 t -83.79 139.16 32.87 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.029 -179.644 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.717 ' C ' HG23 ' A' ' 30' ' ' ILE . 5.5 m-85 -119.56 -14.93 9.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.967 -179.925 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.517 ' HA2' ' CG1' ' A' ' 30' ' ' ILE . . . 132.09 -165.22 23.6 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.557 179.94 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 50' ' ' GLY . . . . . 0.514 ' O ' ' CB ' ' A' ' 51' ' ' SER . . . -91.98 67.09 2.12 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.534 -179.977 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 51' ' ' SER . . . . . 0.514 ' CB ' ' O ' ' A' ' 50' ' ' GLY . 0.1 OUTLIER 159.66 -51.73 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.756 0.312 . . . . 0.0 110.908 179.99 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 9.5 mtt-85 -57.27 -19.08 19.54 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.904 179.925 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 53' ' ' GLY . . . . . 0.472 ' O ' ' CD1' ' A' ' 48' ' ' TYR . . . 73.54 172.46 24.76 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.597 179.832 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.577 ' CG ' ' O ' ' A' ' 54' ' ' PHE . 11.3 p90 -114.23 96.59 5.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.828 0.346 . . . . 0.0 110.838 179.989 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 61.0 m-20 -71.14 138.31 49.54 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.708 179.991 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.506 ' SG ' ' CD2' ' A' ' 54' ' ' PHE . 3.0 m -144.2 162.11 37.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.942 0.401 . . . . 0.0 111.231 -179.648 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 57' ' ' GLU . . . . . 0.458 ' O ' ' O ' ' A' ' 58' ' ' SER . 0.5 OUTLIER -162.72 160.9 26.03 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.771 179.857 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 58' ' ' SER . . . . . 0.458 ' O ' ' O ' ' A' ' 57' ' ' GLU . 0.6 OUTLIER -37.3 161.01 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.945 179.993 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.034 -179.932 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 . . . . . 0 N--CA 1.454 -0.231 0 CA-C-O 120.824 0.345 . . . . 0.0 110.609 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.762 ' O ' HG23 ' A' ' 65' ' ' THR . 5.8 tt0 66.26 114.37 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.921 179.86 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.762 HG23 ' O ' ' A' ' 64' ' ' GLU . 0.2 OUTLIER 171.82 169.33 0.1 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.195 179.985 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.442 ' HB2' ' C ' ' A' ' 75' ' ' TYR . 0.8 OUTLIER -153.05 -175.09 5.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.783 179.98 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -129.78 -37.22 1.55 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.943 -179.928 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 68' ' ' ASP . . . . . 0.445 ' O ' ' O ' ' A' ' 69' ' ' LYS . 27.3 t0 59.98 63.99 1.35 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.806 179.997 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.445 ' O ' ' O ' ' A' ' 68' ' ' ASP . 9.7 ptmt -45.44 176.07 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.882 179.98 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 70' ' ' TYR . . . . . 0.872 ' O ' HG23 ' A' ' 71' ' ' THR . 20.4 m-85 65.37 17.78 11.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.955 -179.997 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.872 HG23 ' O ' ' A' ' 70' ' ' TYR . 0.7 OUTLIER -177.75 -34.47 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.218 -179.994 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 80.04 42.62 10.64 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.553 -179.991 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 73' ' ' ASN . . . . . 0.409 ' O ' ' CB ' ' A' ' 68' ' ' ASP . 0.1 OUTLIER -100.58 116.12 31.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.791 0.329 . . . . 0.0 110.855 179.97 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.43 ' O ' ' NH2' ' A' ' 76' ' ' ARG . 5.2 m -70.61 100.47 1.84 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.101 179.957 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.442 ' C ' ' HB2' ' A' ' 66' ' ' CYS . 3.9 m-30 -92.29 -174.49 3.74 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.853 -179.953 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 76' ' ' ARG . . . . . 0.43 ' NH2' ' O ' ' A' ' 74' ' ' THR . 0.6 OUTLIER -129.69 157.71 41.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.808 179.938 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.489 ' HB ' ' HG3' ' A' ' 64' ' ' GLU . 75.7 t -63.67 -20.57 26.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.136 179.941 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -91.18 31.0 5.91 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.461 179.933 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -148.9 148.44 29.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.882 0.372 . . . . 0.0 111.114 179.971 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.776 HG22 HG23 ' A' ' 93' ' ' THR . 80.6 p -125.39 169.61 12.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.026 179.974 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 81' ' ' TYR . . . . . 0.478 ' OH ' HG21 ' A' ' 102' ' ' ILE . 11.0 p90 -174.29 134.92 0.43 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.936 179.96 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.419 ' HG3' ' HA ' ' A' ' 91' ' ' ASP . 11.6 mp0 -87.82 165.39 15.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.968 -179.996 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 83' ' ' ARG . . . . . 0.512 ' NE ' ' HD2' ' A' ' 84' ' ' PRO . 0.0 OUTLIER -148.3 113.13 3.8 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.772 179.966 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.512 ' HD2' ' NE ' ' A' ' 83' ' ' ARG . 37.4 Cg_endo -66.2 74.1 0.36 Allowed 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.699 2.266 . . . . 0.0 112.254 179.986 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.565 ' HE2' ' CE2' ' A' ' 70' ' ' TYR . 4.9 mmtt -100.08 131.06 46.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.871 -179.959 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 9.5 t0 57.23 -173.85 0.08 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.778 179.962 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 87' ' ' SER . . . . . 0.456 ' O ' ' HB2' ' A' ' 88' ' ' MET . 8.5 m -72.48 58.58 0.41 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.958 179.967 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 88' ' ' MET . . . . . 0.456 ' HB2' ' O ' ' A' ' 87' ' ' SER . 1.9 ttm 176.48 166.93 0.47 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.859 -179.999 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 1.9 mp -123.84 146.18 29.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.108 179.989 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 90' ' ' TRP . . . . . 0.623 ' CD1' ' N ' ' A' ' 90' ' ' TRP . 0.0 OUTLIER -137.09 139.17 41.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.811 -179.941 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.419 ' HA ' ' HG3' ' A' ' 82' ' ' GLU . 6.0 m-20 -77.91 63.36 2.91 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.757 179.889 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 92' ' ' CYS . . . . . 0.444 ' HA ' ' O ' ' A' ' 103' ' ' SER . 3.8 m -44.88 112.52 0.44 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.163 -179.895 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.776 HG23 HG22 ' A' ' 80' ' ' THR . 0.9 OUTLIER -96.48 143.49 27.45 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.78 179.771 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 94' ' ' CYS . . . . . 0.424 ' SG ' ' O ' ' A' ' 76' ' ' ARG . 3.5 t -74.58 81.44 1.99 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.047 -179.822 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.557 HD12 ' HB2' ' A' ' 103' ' ' SER . 2.6 mt -101.51 145.11 12.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.209 179.987 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 116.05 146.43 8.67 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.499 -179.914 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -89.27 45.32 1.28 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.806 0.336 . . . . 0.0 111.154 -179.91 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 98' ' ' GLY . . . . . 0.405 ' O ' ' HB2' ' A' ' 99' ' ' ARG . . . 142.05 -9.45 2.5 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.649 179.849 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.518 ' O ' ' N ' ' A' ' 101' ' ' ARG . 0.9 OUTLIER 173.6 -40.84 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.782 0.325 . . . . 0.0 110.936 -179.983 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 0.404 ' C ' ' O ' ' A' ' 99' ' ' ARG . . . 38.16 -91.5 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.384 -179.958 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.518 ' N ' ' O ' ' A' ' 99' ' ' ARG . 0.0 OUTLIER -179.03 33.68 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.748 0.309 . . . . 0.0 110.982 179.758 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.478 HG21 ' OH ' ' A' ' 81' ' ' TYR . 3.2 mt 28.55 89.26 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.671 179.756 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.557 ' HB2' HD12 ' A' ' 95' ' ' ILE . 1.4 t -55.78 148.49 16.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.868 179.941 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.447 ' SG ' ' O ' ' A' ' 103' ' ' SER . 18.5 m -157.17 142.82 17.52 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.973 -179.939 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -162.18 134.61 5.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.069 179.996 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.578 HG13 ' CE3' ' A' ' 90' ' ' TRP . 3.5 mt -51.15 142.12 3.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.086 179.887 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -63.0 170.22 2.87 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.126 179.929 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -96.87 95.19 7.69 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.945 179.999 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.247 -0.883 . . . . 0.0 110.924 179.969 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo . . . . . 0 N--CA 1.464 -0.237 0 CA-C-O 120.874 0.281 . . . . 0.0 112.522 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 20' ' ' GLY . . . . . 0.556 ' HA2' HD11 ' A' ' 30' ' ' ILE . . . 79.51 159.8 17.93 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.623 179.791 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.6 m -92.03 174.3 7.39 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.743 0.306 . . . . 0.0 110.921 179.936 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 85.3 t80 177.61 143.98 0.1 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.864 -179.976 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 166.66 169.7 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.87 179.977 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.418 ' CG ' ' O ' ' A' ' 24' ' ' ASN . 35.1 t30 54.09 24.34 4.73 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.902 179.927 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 77.4 6.73 86.76 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.576 179.94 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.585 ' HB3' ' CE1' ' A' ' 28' ' ' TYR . 2.1 ttpt -119.74 149.48 41.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.75 0.309 . . . . 0.0 110.876 -179.985 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 -116.51 96.42 5.51 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.109 -179.834 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.585 ' CE1' ' HB3' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -90.73 171.53 9.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.96 -179.995 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.486 ' O ' ' HB2' ' A' ' 32' ' ' GLN . 0.1 OUTLIER -95.17 173.88 7.34 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.905 179.934 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.676 HD12 ' HA2' ' A' ' 49' ' ' GLY . 33.5 mm -72.45 148.41 9.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.166 -179.989 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 65.6 m-20 64.24 10.73 5.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.852 -179.918 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.486 ' HB2' ' O ' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -88.78 158.31 18.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.784 -179.999 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -119.29 138.59 52.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.956 -179.87 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 34' ' ' TRP . . . . . 0.563 ' CE2' ' HB2' ' A' ' 45' ' ' CYS . 37.2 p90 -149.59 -179.77 7.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.037 -179.904 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.49 ' HG2' ' O ' ' A' ' 43' ' ' LEU . 3.9 tt0 -117.58 128.82 55.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.577 -179.991 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 36' ' ' ARG . . . . . 0.993 ' O ' HD22 ' A' ' 43' ' ' LEU . 2.9 ttt180 -114.82 169.79 8.82 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.811 0.338 . . . . 0.0 110.965 -179.985 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.1 m -130.05 130.48 44.97 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.644 -179.916 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -147.74 143.78 27.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.791 179.85 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.501 HD13 ' HA ' ' A' ' 39' ' ' LEU . 0.5 OUTLIER 51.24 35.28 13.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.681 -179.838 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 66.95 38.8 93.07 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.827 -0.701 . . . . 0.0 112.494 -179.89 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 36.3 m-20 -134.87 179.77 6.1 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 120.856 0.36 . . . . 0.0 110.934 -179.93 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.886 ' C ' HD13 ' A' ' 43' ' ' LEU . . . -125.67 118.75 26.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.988 179.859 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.993 HD22 ' O ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -124.9 163.67 21.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.961 0.41 . . . . 0.0 111.347 -179.871 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 44' ' ' VAL . . . . . 0.476 ' HA ' ' HA ' ' A' ' 35' ' ' GLU . 2.4 t -111.97 125.06 69.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.092 179.163 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.563 ' HB2' ' CE2' ' A' ' 34' ' ' TRP . 89.0 m -103.66 163.75 12.11 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.789 -178.874 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.445 ' O ' ' HA ' ' A' ' 54' ' ' PHE . 21.1 m -146.13 119.28 8.85 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.601 179.708 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.539 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 13.4 t -79.06 154.94 29.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.128 -179.61 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.423 ' C ' HG23 ' A' ' 30' ' ' ILE . 15.4 m-85 -123.49 -47.66 1.97 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.851 179.908 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 49' ' ' GLY . . . . . 0.676 ' HA2' HD12 ' A' ' 30' ' ' ILE . . . 119.22 139.21 5.95 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.418 -179.888 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 78.04 -111.3 3.22 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.747 179.874 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -117.86 -4.14 11.14 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.721 0.296 . . . . 0.0 111.152 -179.81 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 6.5 mtt180 -55.57 -26.14 41.9 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.985 -179.896 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 69.01 -173.65 34.83 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.536 179.908 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.579 ' CD1' ' O ' ' A' ' 54' ' ' PHE . 29.5 p90 -129.68 122.65 29.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.893 0.378 . . . . 0.0 111.007 -179.952 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -91.2 147.73 22.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.489 179.795 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.471 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.8 OUTLIER -137.35 156.51 48.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.926 0.393 . . . . 0.0 111.181 -179.834 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -144.59 133.56 22.63 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.797 179.923 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 22.9 t -37.43 130.52 0.95 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.057 179.972 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.87 179.899 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.619 ' HG3' ' HB1' ' A' ' 97' ' ' ALA . 1.2 tt0 . . . . . 0 N--CA 1.455 -0.196 0 CA-C-O 120.907 0.384 . . . . 0.0 110.505 . . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 64' ' ' GLU . . . . . 0.483 ' O ' HG23 ' A' ' 65' ' ' THR . 12.1 mt-10 -64.34 82.57 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.899 -179.77 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.483 HG23 ' O ' ' A' ' 64' ' ' GLU . 0.0 OUTLIER -177.24 166.32 2.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.192 179.899 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.467 ' O ' HG23 ' A' ' 74' ' ' THR . 0.8 OUTLIER -158.9 178.76 9.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.9 -179.817 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.437 ' O ' ' N ' ' A' ' 69' ' ' LYS . 44.8 t80 -131.49 85.04 2.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.883 179.985 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 68' ' ' ASP . . . . . 0.51 ' O ' ' N ' ' A' ' 72' ' ' GLY . 10.1 p-10 -53.65 86.83 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.964 179.994 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 69' ' ' LYS . . . . . 0.437 ' N ' ' O ' ' A' ' 67' ' ' PHE . 0.1 OUTLIER -40.32 -46.95 2.43 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.914 179.933 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 70' ' ' TYR . . . . . 0.411 ' C ' ' O ' ' A' ' 69' ' ' LYS . 8.7 m-30 -36.59 -74.94 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.954 179.928 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -93.79 -41.38 9.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.019 -179.976 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 72' ' ' GLY . . . . . 0.51 ' N ' ' O ' ' A' ' 68' ' ' ASP . . . 108.02 -3.44 33.61 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.661 -0.781 . . . . 0.0 112.468 -179.994 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 73' ' ' ASN . . . . . 0.492 ' OD1' ' N ' ' A' ' 73' ' ' ASN . 0.3 OUTLIER -73.21 102.57 3.67 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.836 0.351 . . . . 0.0 110.848 -179.982 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.467 HG23 ' O ' ' A' ' 66' ' ' CYS . 93.1 m -41.69 134.39 2.48 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.081 179.941 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 75' ' ' TYR . . . . . 0.421 ' HB2' ' SG ' ' A' ' 66' ' ' CYS . 14.3 m-85 -122.76 -174.26 2.88 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.739 179.959 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -117.7 149.46 40.7 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.804 179.94 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.452 ' CG1' ' HG2' ' A' ' 64' ' ' GLU . 9.6 p -63.08 -28.73 45.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.085 -179.991 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -91.69 11.13 72.99 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.518 179.872 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -126.07 153.9 43.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.836 0.351 . . . . 0.0 110.897 179.99 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.577 ' HB ' HG23 ' A' ' 93' ' ' THR . 0.1 OUTLIER -127.07 167.68 15.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.152 -179.883 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 81' ' ' TYR . . . . . 0.485 ' OH ' HG21 ' A' ' 102' ' ' ILE . 0.5 OUTLIER -149.56 154.1 38.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.885 -179.98 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -102.4 164.59 11.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.941 179.959 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 169.95 121.96 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.769 -179.998 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 84' ' ' PRO . . . . . 0.454 ' HA ' ' HA ' ' A' ' 89' ' ' ILE . 45.4 Cg_endo -68.45 161.49 44.7 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.73 2.287 . . . . 0.0 112.421 -179.962 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.432 ' O ' ' NE1' ' A' ' 90' ' ' TRP . 11.4 tptt 173.86 161.98 0.17 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.897 179.973 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 86' ' ' ASP . . . . . 0.489 ' O ' ' CB ' ' A' ' 87' ' ' SER . 1.1 m-20 56.81 19.97 4.84 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.934 -179.98 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 87' ' ' SER . . . . . 0.489 ' CB ' ' O ' ' A' ' 86' ' ' ASP . 1.4 t 82.16 18.61 0.35 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.876 -179.993 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 88' ' ' MET . . . . . 0.621 ' SD ' HD11 ' A' ' 106' ' ' ILE . 5.6 ttm -162.2 172.68 15.39 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.958 -179.941 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 89' ' ' ILE . . . . . 0.507 ' C ' ' CD1' ' A' ' 90' ' ' TRP . 2.8 mt -96.75 141.85 14.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.054 179.912 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 90' ' ' TRP . . . . . 0.584 ' CE3' ' HB ' ' A' ' 106' ' ' ILE . 0.5 OUTLIER -142.89 84.61 1.85 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.84 -179.985 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -38.88 92.23 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.715 -179.935 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 92' ' ' CYS . . . . . 0.505 ' N ' ' O ' ' A' ' 90' ' ' TRP . 0.1 OUTLIER -81.73 129.29 34.67 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.013 -179.955 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.577 HG23 ' HB ' ' A' ' 80' ' ' THR . 63.3 m -114.8 135.66 53.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.086 179.905 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 6.7 t -59.6 88.67 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.097 -179.91 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 95' ' ' ILE . . . . . 0.479 HG13 ' O ' ' A' ' 93' ' ' THR . 1.3 mt -109.34 87.93 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.282 -179.874 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -176.76 -39.71 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.848 -0.692 . . . . 0.0 112.515 179.942 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 97' ' ' ALA . . . . . 0.619 ' HB1' ' HG3' ' A' ' 63' ' ' GLU . . . 62.68 35.04 14.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.842 0.353 . . . . 0.0 111.205 179.932 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 98' ' ' GLY . . . . . 0.442 ' O ' ' HD3' ' A' ' 99' ' ' ARG . . . 140.42 -10.52 2.97 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.59 -0.814 . . . . 0.0 112.677 179.952 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 99' ' ' ARG . . . . . 0.442 ' HD3' ' O ' ' A' ' 98' ' ' GLY . 0.2 OUTLIER 176.49 -83.29 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.805 0.336 . . . . 0.0 110.793 -179.899 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 100' ' ' GLY . . . . . 0.469 ' O ' ' HB3' ' A' ' 101' ' ' ARG . . . 35.54 -108.32 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.546 179.965 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 101' ' ' ARG . . . . . 0.564 ' N ' ' CD ' ' A' ' 101' ' ' ARG . 0.0 OUTLIER 176.95 104.59 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.841 0.353 . . . . 0.0 110.92 179.983 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.485 HG21 ' OH ' ' A' ' 81' ' ' TYR . 2.7 mp -52.2 116.42 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.222 179.986 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 103' ' ' SER . . . . . 0.473 ' O ' ' HA ' ' A' ' 92' ' ' CYS . 3.8 t -82.26 139.74 34.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.771 179.911 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 104' ' ' CYS . . . . . 0.403 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 0.5 OUTLIER -114.91 113.41 24.14 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.997 -179.875 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 1.4 p -97.02 109.4 22.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.048 179.809 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 106' ' ' ILE . . . . . 0.96 HD13 ' N ' ' A' ' 107' ' ' ALA . 0.0 OUTLIER -58.53 150.29 4.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.338 -179.927 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 107' ' ' ALA . . . . . 0.96 ' N ' HD13 ' A' ' 106' ' ' ILE . . . -99.98 126.84 46.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.946 179.822 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 -109.22 -13.25 14.68 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.036 -179.901 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.214 -0.898 . . . . 0.0 110.794 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 120.764 0.316 . . . . 0.0 111.154 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -171.89 131.26 0.72 Allowed Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.965 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -74.19 -165.48 0.27 Allowed 'Trans proline' 0 C--O 1.231 0.15 0 C-N-CA 122.818 2.345 . . . . 0.0 112.432 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 119.11 177.17 16.48 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.513 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -143.1 107.19 4.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.821 0.343 . . . . 0.0 111.046 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -96.37 118.16 32.34 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.691 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.4 ' OD2' ' CD ' ' A' ' 36' ' ' ARG . 0.2 OUTLIER -149.52 149.69 31.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.963 -179.944 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 39.8 t30 47.14 30.12 1.3 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.95 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 71.36 16.87 75.7 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.546 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.459 ' HB3' ' CZ ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -115.14 155.74 26.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.821 0.343 . . . . 0.0 110.823 -179.991 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 18.6 t-80 -111.38 83.97 1.86 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.151 -179.713 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.459 ' CZ ' ' HB3' ' A' ' 26' ' ' LYS . 0.9 OUTLIER -82.6 173.68 11.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.784 179.746 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.524 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 1.0 OUTLIER -109.74 140.92 43.07 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.596 179.709 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.66 HD12 ' H ' ' A' ' 30' ' ' ILE . 4.0 mp -36.47 151.62 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.207 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.452 ' HB2' ' O ' ' A' ' 30' ' ' ILE . 29.7 m-80 66.53 13.22 9.19 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.789 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.524 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 13.4 tt0 -100.46 149.16 23.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.844 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.46 ' HG2' ' OG1' ' A' ' 46' ' ' THR . 14.1 mt-30 -115.99 143.93 44.77 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.178 -179.715 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' TRP . . . . . 0.589 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 37.6 p90 -145.69 162.43 37.57 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.6 179.616 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -100.0 128.19 46.11 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.979 0.419 . . . . 0.0 111.439 -179.519 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.4 ' CD ' ' OD2' ' A' ' 23' ' ' ASP . 0.0 OUTLIER -132.2 -163.26 1.31 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.278 179.527 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.46 ' HA ' ' O ' ' A' ' 41' ' ' ASN . 1.2 t -147.46 134.73 20.6 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.822 0.344 . . . . 0.0 111.244 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.945 ' HB2' HD22 ' A' ' 43' ' ' LEU . 0.3 OUTLIER -90.02 89.67 7.8 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.486 179.71 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.499 ' CB ' ' O ' ' A' ' 38' ' ' TYR . 1.4 tp 82.89 -48.42 0.16 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.721 -179.729 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 178.53 34.9 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.867 -0.683 . . . . 0.0 112.557 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.46 ' O ' ' HA ' ' A' ' 37' ' ' THR . 85.9 m-20 -148.18 148.59 30.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.659 0.266 . . . . 0.0 110.934 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.434 ' C ' ' O ' ' A' ' 41' ' ' ASN . . . -36.53 141.96 0.1 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.695 179.737 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.945 HD22 ' HB2' ' A' ' 38' ' ' TYR . 21.9 tp -169.92 99.38 0.3 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.85 0.357 . . . . 0.0 111.27 -179.567 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.509 ' N ' ' O ' ' A' ' 57' ' ' GLU . 24.8 t -75.92 159.53 5.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.569 179.492 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.589 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 0.0 OUTLIER -140.77 144.91 35.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.856 0.36 . . . . 0.0 111.266 -179.769 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.46 ' OG1' ' HG2' ' A' ' 33' ' ' GLN . 86.1 m -129.66 123.48 31.31 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.915 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.477 ' SG ' ' HA ' ' A' ' 30' ' ' ILE . 30.3 t -80.63 137.61 36.36 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.002 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.437 ' CE1' ' O ' ' A' ' 46' ' ' THR . 5.5 m-85 -117.05 -2.27 11.75 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.975 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.561 ' N ' HG23 ' A' ' 30' ' ' ILE . . . 135.02 -173.62 21.51 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.438 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -85.13 -11.12 76.79 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.485 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -109.49 -44.32 3.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.819 0.342 . . . . 0.0 110.954 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 3.9 mtt180 -73.38 -29.39 62.59 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.049 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 75.26 -156.45 48.68 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.549 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.534 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 12.1 p90 -134.07 150.0 51.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.889 0.376 . . . . 0.0 110.952 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -120.46 104.39 9.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.839 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.478 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 1.2 m -67.48 163.78 20.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.936 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.632 ' C ' HD12 ' A' ' 43' ' ' LEU . 0.2 OUTLIER -166.6 142.34 4.53 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.862 179.889 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.48 ' N ' HD12 ' A' ' 43' ' ' LEU . 3.4 m -69.38 146.49 52.05 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.879 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.426 ' C ' ' O ' ' A' ' 58' ' ' SER . 0.9 OUTLIER -36.55 103.05 0.24 Allowed Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.871 179.947 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -49.82 145.2 18.81 Favored 'Trans proline' 0 N--CA 1.465 -0.169 0 C-N-CA 122.844 2.363 . . . . 0.0 112.482 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.44 ' O ' ' O ' ' A' ' 62' ' ' ALA . 44.9 tt0 -157.45 57.39 0.5 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.747 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.44 ' O ' ' O ' ' A' ' 61' ' ' GLU . . . 50.85 105.67 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.075 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.509 ' O ' ' CB ' ' A' ' 64' ' ' GLU . 3.0 tt0 -108.57 112.45 24.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.572 -179.859 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.664 ' O ' HG23 ' A' ' 65' ' ' THR . 3.6 mt-10 159.37 63.05 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.078 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.664 HG23 ' O ' ' A' ' 64' ' ' GLU . 0.1 OUTLIER 170.66 154.54 0.06 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.13 179.958 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 17.8 m -126.07 -154.55 0.63 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.835 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.406 ' O ' ' N ' ' A' ' 73' ' ' ASN . 44.6 t80 -158.3 -40.31 0.06 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.024 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ASP . . . . . 0.515 ' O ' ' N ' ' A' ' 72' ' ' GLY . 3.7 t0 71.01 70.07 0.18 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.968 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -43.05 -29.41 0.35 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.915 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.584 ' CE2' ' HE3' ' A' ' 85' ' ' LYS . 7.5 m-30 -53.28 -54.18 40.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.947 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 25.4 m -119.97 -36.5 3.26 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.072 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' GLY . . . . . 0.515 ' N ' ' O ' ' A' ' 68' ' ' ASP . . . 97.79 47.71 2.06 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.439 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ASN . . . . . 0.491 ' HB3' ' CZ ' ' A' ' 75' ' ' TYR . 0.4 OUTLIER -96.77 -172.56 2.5 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.787 0.327 . . . . 0.0 110.844 -179.979 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.491 ' O ' ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -120.78 117.99 28.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.016 179.913 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.491 ' CZ ' ' HB3' ' A' ' 73' ' ' ASN . 9.6 m-85 -136.87 144.75 43.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.906 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -83.53 165.19 19.31 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.961 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 13.5 p -81.11 -18.46 11.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.169 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -100.92 42.96 1.82 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.509 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -164.21 133.1 3.7 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.813 0.34 . . . . 0.0 110.964 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 58.2 p -93.6 163.72 13.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.187 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 33.2 p90 -160.65 110.7 1.75 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.856 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -55.5 160.5 2.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.021 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.422 ' HA ' ' HD2' ' A' ' 84' ' ' PRO . 0.0 OUTLIER -148.91 96.59 3.75 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.8 179.888 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.422 ' HD2' ' HA ' ' A' ' 83' ' ' ARG . 36.8 Cg_endo -65.79 114.91 3.14 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.769 2.312 . . . . 0.0 112.333 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.584 ' HE3' ' CE2' ' A' ' 70' ' ' TYR . 0.5 OUTLIER -141.67 111.14 6.46 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.839 -179.978 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.454 ' CB ' ' O ' ' A' ' 85' ' ' LYS . 0.9 OUTLIER 80.65 -159.16 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.768 -179.963 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.445 ' O ' ' OG ' ' A' ' 87' ' ' SER . 2.3 t -89.85 17.32 6.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.919 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.581 ' HG2' ' CZ2' ' A' ' 90' ' ' TRP . 16.5 tpp -131.61 129.74 41.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.829 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -92.03 139.29 18.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.177 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' TRP . . . . . 0.581 ' CZ2' ' HG2' ' A' ' 88' ' ' MET . 1.7 m95 -136.4 152.21 50.37 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.823 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -104.89 87.65 2.71 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.842 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 73.2 m -67.26 140.71 57.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.013 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.569 HG22 HG12 ' A' ' 95' ' ' ILE . 86.6 m -123.94 122.53 38.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.127 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.448 ' SG ' ' HB2' ' A' ' 75' ' ' TYR . 0.0 OUTLIER -63.08 69.65 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.798 -179.993 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.569 HG12 HG22 ' A' ' 93' ' ' THR . 1.2 mt -89.64 46.89 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.353 -179.845 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.454 ' HA2' ' HA2' ' A' ' 100' ' ' GLY . . . -52.4 -81.59 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.484 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.409 ' HA ' ' HG3' ' A' ' 63' ' ' GLU . . . 61.38 -89.05 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.811 0.338 . . . . 0.0 111.098 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -71.11 -30.59 67.39 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.488 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 9.1 ttt180 -174.87 -67.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.846 0.355 . . . . 0.0 110.923 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 0.454 ' HA2' ' HA2' ' A' ' 96' ' ' GLY . . . -167.84 91.05 0.1 OUTLIER Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.486 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 4.5 ttt85 -109.25 42.28 1.48 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.808 0.337 . . . . 0.0 110.971 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.403 ' HA ' ' O ' ' A' ' 93' ' ' THR . 1.2 mp -52.55 95.9 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.193 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 47.5 t -86.48 123.53 31.8 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.913 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 46.2 m -116.02 101.03 8.38 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.844 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 14.0 t -110.98 142.14 43.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.133 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.579 ' H ' HD12 ' A' ' 106' ' ' ILE . 4.6 mp -44.26 149.05 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.987 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -49.09 139.9 10.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.881 0.372 . . . . 0.0 111.104 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -68.23 -33.28 74.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.897 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.228 -0.891 . . . . 0.0 110.938 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.447 ' OG ' ' HD2' ' A' ' 18' ' ' LYS . 3.8 p . . . . . 0 N--CA 1.485 1.321 0 CA-C-O 120.846 0.355 . . . . 0.0 111.252 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.447 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 0.0 OUTLIER 55.21 89.76 0.1 OUTLIER Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.895 179.99 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.415 ' HB2' HD11 ' A' ' 30' ' ' ILE . 45.0 Cg_exo -56.24 -163.87 0.02 OUTLIER 'Trans proline' 0 C--O 1.231 0.137 0 C-N-CA 122.753 2.302 . . . . 0.0 112.262 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.37 162.82 3.28 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.665 -0.779 . . . . 0.0 112.474 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 25.0 m -127.4 106.85 9.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.87 0.367 . . . . 0.0 110.846 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 32.6 t80 -86.25 120.87 28.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.985 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.452 ' OD1' ' CB ' ' A' ' 26' ' ' LYS . 3.6 p-10 -97.42 -160.29 0.79 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.866 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.429 ' C ' ' O ' ' A' ' 23' ' ' ASP . 0.4 OUTLIER -34.96 -75.67 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.976 -0.557 . . . . 0.0 111.008 -179.983 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -133.64 33.78 2.51 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.632 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.517 ' HB3' ' CE2' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -140.16 141.17 36.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.836 0.351 . . . . 0.0 110.969 -179.997 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 10.4 t-160 -120.44 90.14 3.27 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.968 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.625 ' CE2' ' CB ' ' A' ' 34' ' ' TRP . 93.1 m-85 -87.26 161.64 17.88 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.094 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.532 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 3.6 tt0 -87.56 156.38 19.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.803 179.829 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.705 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.9 mp -44.45 147.73 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.437 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 24.0 m-80 65.03 13.43 8.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.162 179.704 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.532 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 1.0 OUTLIER -99.74 148.6 24.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.879 0.371 . . . . 0.0 110.781 179.851 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -115.96 151.0 36.25 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.913 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' TRP . . . . . 0.625 ' CB ' ' CE2' ' A' ' 28' ' ' TYR . 42.6 p90 -152.65 -174.45 4.92 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.902 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -114.61 132.45 56.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.019 -179.802 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.529 ' O ' ' CB ' ' A' ' 43' ' ' LEU . 3.1 ttt180 -139.22 165.92 25.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.725 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.401 ' OG1' ' C ' ' A' ' 41' ' ' ASN . 2.2 t -136.92 135.9 38.15 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.917 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.797 ' CE1' HD13 ' A' ' 39' ' ' LEU . 1.1 t80 -118.37 125.32 49.76 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.773 179.903 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.797 HD13 ' CE1' ' A' ' 38' ' ' TYR . 0.8 OUTLIER 65.36 14.42 9.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.605 -179.737 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 87.45 44.61 5.51 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.58 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.427 ' O ' ' C ' ' A' ' 42' ' ' ALA . 27.2 m-80 -144.09 125.5 14.8 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.751 0.31 . . . . 0.0 110.89 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.459 ' O ' ' CD1' ' A' ' 43' ' ' LEU . . . -35.04 147.57 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.945 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.529 ' CB ' ' O ' ' A' ' 36' ' ' ARG . 1.5 tp -165.49 157.78 15.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.988 0.423 . . . . 0.0 111.297 -179.686 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.479 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 3.6 t -126.2 135.46 63.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.335 179.382 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.593 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 0.5 OUTLIER -118.79 162.45 18.45 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.428 -179.486 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 20.5 m -147.69 131.14 16.68 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.895 179.799 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.501 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 14.3 t -91.35 132.26 36.3 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.882 0.372 . . . . 0.0 111.052 -179.85 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.499 ' HB2' ' HB3' ' A' ' 52' ' ' ARG . 2.0 m-85 -105.17 -35.96 7.42 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.783 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.515 ' HA3' ' CG2' ' A' ' 30' ' ' ILE . . . 76.63 173.08 36.63 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.489 -179.932 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLY . . . . . 0.52 ' O ' ' CB ' ' A' ' 51' ' ' SER . . . 66.91 18.0 68.15 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.64 -0.79 . . . . 0.0 112.532 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.52 ' CB ' ' O ' ' A' ' 50' ' ' GLY . 1.0 OUTLIER 85.78 -0.56 0.73 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.671 0.272 . . . . 0.0 111.208 179.964 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.499 ' HB3' ' HB2' ' A' ' 48' ' ' TYR . 0.0 OUTLIER -56.87 -27.91 61.07 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.937 0.399 . . . . 0.0 110.882 179.942 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 74.45 129.5 0.19 Allowed Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.67 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.559 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 10.3 p90 -63.97 177.63 0.75 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.843 0.354 . . . . 0.0 110.825 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 79.3 m-20 -152.01 123.92 8.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.929 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.479 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.8 OUTLIER -104.56 155.88 18.45 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.908 179.951 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -170.5 171.75 6.31 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.019 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.432 ' HA ' HD12 ' A' ' 43' ' ' LEU . 0.1 OUTLIER -57.28 136.44 56.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.932 -179.975 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.456 ' O ' ' O ' ' A' ' 60' ' ' PRO . 2.3 tppp? -39.55 136.7 1.12 Allowed Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.054 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.456 ' O ' ' O ' ' A' ' 59' ' ' LYS . 76.4 Cg_exo -49.23 -169.1 0.0 OUTLIER 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.858 2.372 . . . . 0.0 112.36 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -74.58 -59.09 2.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.973 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -150.73 130.33 13.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.113 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -95.45 -31.79 13.2 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.499 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.508 ' HG3' ' CG2' ' A' ' 77' ' ' VAL . 23.2 tt0 -95.85 57.03 1.78 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.904 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.46 HG23 ' O ' ' A' ' 64' ' ' GLU . 22.4 p -157.06 -174.97 5.17 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.194 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -144.7 -165.19 2.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.844 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 86.9 t80 -163.83 97.94 0.86 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.819 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ASP . . . . . 0.486 ' O ' ' N ' ' A' ' 72' ' ' GLY . 3.9 m-20 -72.26 83.57 1.04 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.962 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -39.41 -30.25 0.06 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.882 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 39.0 m-85 -57.45 -61.69 2.31 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.948 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 24.9 p -112.09 19.51 17.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.105 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' GLY . . . . . 0.486 ' N ' ' O ' ' A' ' 68' ' ' ASP . . . 38.69 54.96 2.24 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.547 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 3.8 m-80 -124.22 160.19 28.46 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.835 0.35 . . . . 0.0 110.702 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.52 155.81 17.64 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.19 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 25.5 m-85 -139.09 -172.09 3.25 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.836 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -104.83 155.75 18.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.939 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.528 HG13 ' O ' ' A' ' 94' ' ' CYS . 2.5 t -90.63 25.73 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.071 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -138.44 17.85 3.29 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.62 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -142.04 136.71 30.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.819 0.342 . . . . 0.0 110.974 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.455 HG22 HG23 ' A' ' 93' ' ' THR . 1.4 p -93.67 114.08 26.3 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.116 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.571 ' OH ' HD13 ' A' ' 102' ' ' ILE . 42.5 p90 -102.93 136.47 42.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.883 -179.935 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 90.1 mt-10 -97.37 164.73 12.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.72 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.79 117.68 1.93 Allowed Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.912 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -70.86 103.42 1.34 Allowed 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.671 2.247 . . . . 0.0 112.299 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -134.28 161.65 34.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.986 -179.899 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 51.4 31.08 6.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.932 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 71.34 5.36 5.41 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.087 179.934 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -132.62 178.57 6.74 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.924 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.503 ' C ' ' CD1' ' A' ' 90' ' ' TRP . 1.1 mt -116.67 145.33 22.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.076 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' TRP . . . . . 0.631 ' CZ3' ' CD1' ' A' ' 106' ' ' ILE . 0.0 OUTLIER -144.65 128.56 17.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.908 179.972 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.473 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 3.9 p30 -66.88 95.07 0.35 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.744 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' CYS . . . . . 0.505 ' O ' ' CD1' ' A' ' 81' ' ' TYR . 64.5 m -79.21 96.17 5.83 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.805 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.455 HG23 HG22 ' A' ' 80' ' ' THR . 2.6 m -74.83 148.45 40.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.017 179.934 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.797 ' HA ' HG22 ' A' ' 102' ' ' ILE . 0.1 OUTLIER -96.8 51.01 1.13 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.916 -179.923 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 1.8 mt -44.85 -40.56 2.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.104 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.668 ' O ' ' HB3' ' A' ' 97' ' ' ALA . . . 44.37 -163.08 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.502 179.925 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.668 ' HB3' ' O ' ' A' ' 96' ' ' GLY . . . 83.7 94.84 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.798 0.332 . . . . 0.0 111.075 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 117.67 -62.3 0.42 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.493 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.67 34.59 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.797 0.332 . . . . 0.0 110.88 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 0.449 ' HA2' ' HA2' ' A' ' 96' ' ' GLY . . . 55.16 79.68 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.556 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.518 ' O ' ' CG ' ' A' ' 101' ' ' ARG . 1.4 tmt_? -106.9 56.77 0.64 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.843 0.354 . . . . 0.0 110.862 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.797 HG22 ' HA ' ' A' ' 94' ' ' CYS . 0.8 OUTLIER -50.3 139.74 4.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.288 -179.922 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 12.1 t -115.84 129.69 56.53 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.745 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.471 ' HB3' ' HB2' ' A' ' 90' ' ' TRP . 8.9 m -118.58 143.38 46.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.002 -179.842 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' THR . . . . . 0.474 ' O ' ' HA ' ' A' ' 90' ' ' TRP . 0.3 OUTLIER -151.65 153.77 35.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.039 179.913 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.631 ' CD1' ' CZ3' ' A' ' 90' ' ' TRP . 2.8 mp -59.71 156.6 2.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.311 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.477 ' N ' HG22 ' A' ' 106' ' ' ILE . . . 46.51 -178.57 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.292 179.856 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -97.58 40.78 1.14 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.847 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.102 0 CA-C-O 118.299 -0.858 . . . . 0.0 110.91 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.442 ' O ' ' O ' ' A' ' 18' ' ' LYS . 4.4 m . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 120.762 0.315 . . . . 0.0 111.062 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.442 ' O ' ' O ' ' A' ' 17' ' ' SER . 4.5 mmtp 58.32 145.76 0.05 OUTLIER Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.759 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.702 ' HB2' HD11 ' A' ' 30' ' ' ILE . 41.6 Cg_endo -67.15 119.63 6.67 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.655 2.237 . . . . 0.0 112.348 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 154.5 -163.13 31.04 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.684 -0.769 . . . . 0.0 112.536 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 80.4 m -139.39 72.65 1.41 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.818 0.342 . . . . 0.0 110.893 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 30.8 t80 -52.5 117.96 3.25 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.815 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -164.86 150.26 9.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.885 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.435 ' CG ' ' O ' ' A' ' 24' ' ' ASN . 28.1 t-20 62.25 26.66 15.98 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.904 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 72.2 11.31 75.23 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.592 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.585 ' HB3' ' CE1' ' A' ' 28' ' ' TYR . 0.4 OUTLIER -122.12 151.59 40.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.814 0.34 . . . . 0.0 110.863 -179.923 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 5.1 t-160 -111.92 89.98 3.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.085 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.585 ' CE1' ' HB3' ' A' ' 26' ' ' LYS . 3.5 m-85 -79.62 171.02 15.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.028 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.529 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 0.9 OUTLIER -111.92 139.26 47.56 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.82 179.915 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.702 HD11 ' HB2' ' A' ' 19' ' ' PRO . 3.9 mp -35.0 140.38 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.534 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 13.5 m-20 72.62 8.75 5.65 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.15 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.529 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 56.1 tt0 -97.82 155.24 17.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.849 0.357 . . . . 0.0 111.057 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.623 ' CG ' HG23 ' A' ' 46' ' ' THR . 28.5 mt-30 -118.05 156.99 27.64 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.867 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' TRP . . . . . 0.588 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 38.2 p90 -155.35 166.95 31.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.707 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -99.77 123.13 43.72 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.169 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.62 -163.91 0.92 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.609 179.754 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.585 HG23 ' O ' ' A' ' 37' ' ' THR . 3.4 t -167.08 32.37 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.353 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.732 ' HB2' HD22 ' A' ' 43' ' ' LEU . 0.2 OUTLIER -40.33 143.87 0.27 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.847 179.905 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.463 ' HB2' ' O ' ' A' ' 38' ' ' TYR . 2.3 mm? 66.5 16.5 10.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.857 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 66.95 42.07 92.94 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.524 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.464 ' O ' ' HA ' ' A' ' 37' ' ' THR . 51.6 m-80 -152.23 132.11 13.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.596 0.236 . . . . 0.0 110.781 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.772 ' O ' HD12 ' A' ' 43' ' ' LEU . . . -31.01 135.1 0.06 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.458 -179.761 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.93 HD23 ' HB3' ' A' ' 56' ' ' CYS . 0.7 OUTLIER -153.86 174.66 14.3 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.13 -179.732 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.503 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.6 t -144.88 127.05 9.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.478 179.541 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.588 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 0.8 OUTLIER -117.72 163.41 16.52 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.383 -179.528 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.623 HG23 ' CG ' ' A' ' 33' ' ' GLN . 2.0 m -145.13 134.81 23.42 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.926 179.78 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.57 ' N ' ' CH2' ' A' ' 34' ' ' TRP . 14.0 t -82.58 135.13 35.15 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.928 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.47 ' C ' HG23 ' A' ' 30' ' ' ILE . 2.2 m-85 -110.62 -32.35 6.92 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.881 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 92.03 -166.95 30.16 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.519 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 42.0 -114.73 0.73 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.751 -0.737 . . . . 0.0 112.631 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -126.07 1.63 7.22 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.659 0.266 . . . . 0.0 111.208 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.508 ' NE ' ' HA ' ' A' ' 52' ' ' ARG . 0.1 OUTLIER -59.25 -38.39 79.95 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.785 0.326 . . . . 0.0 110.98 -179.923 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 70.59 141.34 0.19 Allowed Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.631 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.574 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 7.7 p90 -59.7 172.97 0.62 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.848 0.356 . . . . 0.0 110.807 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -156.06 108.35 2.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.762 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.93 ' HB3' HD23 ' A' ' 43' ' ' LEU . 2.1 m -75.5 172.18 12.98 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.032 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -141.28 -94.06 0.14 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.125 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.9 t 178.86 131.33 0.08 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.874 0.369 . . . . 0.0 110.917 -179.889 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.595 ' CB ' ' HB1' ' A' ' 42' ' ' ALA . 0.2 OUTLIER -82.0 114.27 49.4 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.792 179.905 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_exo -42.76 111.42 0.21 Allowed 'Trans proline' 0 N--CA 1.462 -0.336 0 C-N-CA 122.709 2.273 . . . . 0.0 112.369 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -117.54 22.42 12.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.919 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -161.5 -165.02 1.21 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.124 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -99.71 -29.23 12.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.57 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 72.77 -172.65 0.14 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.947 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.447 ' HA ' ' O ' ' A' ' 75' ' ' TYR . 24.4 p 48.83 -167.03 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.02 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.625 ' O ' HG23 ' A' ' 74' ' ' THR . 5.7 p 167.23 177.8 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.962 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 38.3 t80 -129.36 111.53 12.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.906 179.89 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -79.38 94.13 5.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.926 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.434 ' HB3' ' CE1' ' A' ' 70' ' ' TYR . 0.1 OUTLIER -51.87 173.91 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.749 179.925 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.481 ' CD1' ' N ' ' A' ' 70' ' ' TYR . 0.8 OUTLIER 76.19 -54.58 0.6 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.815 -179.961 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -107.22 -17.57 14.12 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.108 179.909 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 54.07 72.72 0.5 Allowed Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.48 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -140.83 96.27 2.99 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.789 0.328 . . . . 0.0 110.838 -179.898 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.625 HG23 ' O ' ' A' ' 66' ' ' CYS . 85.0 m -50.74 135.99 22.69 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.033 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.447 ' O ' ' HA ' ' A' ' 65' ' ' THR . 21.9 m-85 -129.47 175.3 8.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.893 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.09 133.84 41.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.826 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.402 ' HA ' ' O ' ' A' ' 94' ' ' CYS . 7.1 p -46.4 -39.77 3.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.029 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -94.99 33.14 5.57 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.472 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -135.13 114.67 12.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.882 0.373 . . . . 0.0 110.955 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.608 HG22 HG23 ' A' ' 93' ' ' THR . 44.9 p -86.36 150.31 24.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.163 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.524 ' CE1' ' HB3' ' A' ' 92' ' ' CYS . 32.9 p90 -139.4 -178.6 5.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.808 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.412 ' OE2' ' OD1' ' A' ' 108' ' ' ASN . 1.9 mp0 -115.97 151.38 35.54 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.888 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 14.7 ttm180 -139.31 101.03 7.59 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.96 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -75.34 113.71 3.83 Favored 'Trans proline' 0 N--CA 1.464 -0.264 0 C-N-CA 122.798 2.332 . . . . 0.0 112.364 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.7 mtpp -157.34 161.95 39.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.924 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 50.06 25.5 1.73 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.871 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.2 t 72.98 8.11 5.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.041 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.447 ' O ' ' NE1' ' A' ' 90' ' ' TRP . 0.0 OUTLIER -138.57 134.02 33.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.955 179.991 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.54 ' C ' ' CD1' ' A' ' 90' ' ' TRP . 2.8 mp -85.3 157.97 3.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.058 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' TRP . . . . . 0.55 ' CH2' HD11 ' A' ' 106' ' ' ILE . 4.5 m95 -148.89 107.95 3.89 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.95 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.507 ' N ' ' O ' ' A' ' 105' ' ' THR . 11.1 t70 -58.58 91.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.785 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' CYS . . . . . 0.524 ' HB3' ' CE1' ' A' ' 81' ' ' TYR . 0.8 OUTLIER -74.46 150.49 39.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.134 -179.939 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.608 HG23 HG22 ' A' ' 80' ' ' THR . 41.7 m -127.49 108.1 10.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.993 179.875 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.402 ' O ' ' HA ' ' A' ' 77' ' ' VAL . 20.3 t -53.85 82.35 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.948 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.52 ' N ' ' O ' ' A' ' 93' ' ' THR . 1.5 mt -77.89 -26.57 14.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.216 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.45 ' HA3' ' HA3' ' A' ' 100' ' ' GLY . . . -158.42 164.03 33.26 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.514 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.457 ' O ' ' N ' ' A' ' 99' ' ' ARG . . . -91.92 104.14 16.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.781 0.324 . . . . 0.0 111.098 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 36.95 30.7 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.479 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.457 ' N ' ' O ' ' A' ' 97' ' ' ALA . 0.4 OUTLIER -147.98 -46.14 0.16 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.783 0.325 . . . . 0.0 110.935 -179.962 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 0.48 ' C ' ' CG ' ' A' ' 101' ' ' ARG . . . -65.08 -98.07 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.572 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.48 ' CG ' ' C ' ' A' ' 100' ' ' GLY . 0.0 OUTLIER 172.02 94.3 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.751 0.31 . . . . 0.0 110.95 -179.987 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 43.0 mt -72.07 78.15 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.125 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.461 ' O ' ' HA ' ' A' ' 92' ' ' CYS . 1.4 t -54.93 151.06 9.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.078 -179.915 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.485 ' SG ' ' HB2' ' A' ' 90' ' ' TRP . 0.0 OUTLIER -130.31 150.99 51.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.75 179.924 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 105' ' ' THR . . . . . 0.507 ' O ' ' N ' ' A' ' 91' ' ' ASP . 0.2 OUTLIER -167.28 134.2 2.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.916 0.389 . . . . 0.0 111.356 -179.947 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.55 HD11 ' CH2' ' A' ' 90' ' ' TRP . 1.2 mp -66.57 165.25 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.118 179.863 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.509 ' N ' HG22 ' A' ' 106' ' ' ILE . . . 68.61 120.08 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.142 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' ASN . . . . . 0.412 ' OD1' ' OE2' ' A' ' 82' ' ' GLU . 0.1 OUTLIER -88.73 76.45 8.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.943 -179.979 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 20.0 ttt85 . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.293 -0.861 . . . . 0.0 110.879 179.883 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.486 1.343 0 CA-C-O 120.784 0.326 . . . . 0.0 111.237 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.6 mptt -41.94 146.24 0.64 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.895 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_exo -46.24 110.85 0.3 Allowed 'Trans proline' 0 N--CA 1.465 -0.191 0 C-N-CA 122.713 2.276 . . . . 0.0 112.419 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 137.02 163.29 9.68 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.464 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.3 m -112.14 135.19 53.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.826 0.346 . . . . 0.0 110.914 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -115.09 115.68 27.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.85 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -160.21 159.92 32.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.853 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.428 ' O ' ' CG ' ' A' ' 24' ' ' ASN . 28.3 t-20 58.8 25.19 13.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.9 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 72.89 7.27 69.83 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.443 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.496 ' HB3' ' CZ ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -122.91 142.3 50.95 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.756 0.312 . . . . 0.0 111.004 179.963 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 2.9 t-160 -114.49 88.28 2.82 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.862 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.496 ' CZ ' ' HB3' ' A' ' 26' ' ' LYS . 0.5 OUTLIER -79.63 -170.28 2.3 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.939 -179.939 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.493 ' O ' ' HB2' ' A' ' 32' ' ' GLN . 0.0 OUTLIER -102.12 173.24 6.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.953 -179.962 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.713 HD12 ' H ' ' A' ' 30' ' ' ILE . 2.9 mp -66.4 155.63 7.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.469 -179.777 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 85.7 m-20 53.78 18.02 1.44 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.202 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.493 ' HB2' ' O ' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -95.29 151.46 19.23 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.668 179.823 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 14.9 mt-30 -115.8 144.77 43.53 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.101 -179.732 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' TRP . . . . . 0.549 ' CZ3' ' HB2' ' A' ' 47' ' ' CYS . 41.2 p90 -148.9 178.78 8.38 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.753 179.663 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -103.11 129.87 50.1 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.025 0.441 . . . . 0.0 111.28 -179.715 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.528 ' O ' ' N ' ' A' ' 43' ' ' LEU . 32.5 ttt-85 -132.99 170.66 15.04 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.296 179.558 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.485 ' HA ' ' HB2' ' A' ' 43' ' ' LEU . 1.2 t -139.46 132.78 29.99 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.872 0.368 . . . . 0.0 111.477 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.512 ' CB ' HD22 ' A' ' 43' ' ' LEU . 45.9 t80 -124.05 124.21 42.04 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.655 179.793 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 70.33 22.37 5.39 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.989 0.424 . . . . 0.0 110.478 -179.711 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 76.4 41.06 26.53 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.923 -0.656 . . . . 0.0 112.501 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.441 ' C ' ' HG1' ' A' ' 37' ' ' THR . 69.0 m-80 -145.46 138.08 25.92 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.819 0.342 . . . . 0.0 111.254 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -37.75 152.31 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.876 179.827 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.528 ' N ' ' O ' ' A' ' 36' ' ' ARG . 2.2 tp -167.28 159.62 12.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.22 -179.839 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.503 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.6 t -130.24 129.11 64.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.661 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.567 ' SG ' ' CD1' ' A' ' 54' ' ' PHE . 0.8 OUTLIER -110.75 163.53 13.68 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.32 -179.715 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 35.4 m -144.78 118.41 9.17 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.031 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.549 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 35.2 t -72.71 145.62 47.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.018 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.517 ' CB ' ' HB3' ' A' ' 52' ' ' ARG . 4.9 m-85 -119.39 -16.3 8.98 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.921 179.939 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.538 ' N ' HG23 ' A' ' 30' ' ' ILE . . . 92.57 179.95 40.5 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.505 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLY . . . . . 0.417 ' C ' ' O ' ' A' ' 49' ' ' GLY . . . 36.13 -107.8 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.482 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 28.4 t -131.67 7.79 4.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.776 0.322 . . . . 0.0 111.05 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.517 ' HB3' ' CB ' ' A' ' 48' ' ' TYR . 7.3 mmt180 -52.66 -19.77 2.61 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.966 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 68.62 151.59 0.38 Allowed Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.355 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.567 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 4.3 p90 -92.96 157.95 16.06 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.834 0.35 . . . . 0.0 110.945 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -116.87 115.6 25.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.623 179.824 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.503 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.1 OUTLIER -102.93 152.81 20.87 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.203 -179.778 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -175.26 179.49 1.51 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.814 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 26.7 t -73.9 135.14 43.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.925 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.462 ' CD ' HG21 ' A' ' 44' ' ' VAL . 3.9 tptp -39.88 111.55 0.73 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.931 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -69.61 156.3 64.13 Favored 'Trans proline' 0 C--O 1.232 0.195 0 C-N-CA 122.665 2.243 . . . . 0.0 112.293 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -81.38 -50.14 9.84 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.906 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -156.93 148.21 22.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.062 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -103.7 -38.93 6.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.468 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.01 -176.38 2.07 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.91 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.5 p 64.85 -162.27 0.27 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.198 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.469 ' O ' ' HA ' ' A' ' 74' ' ' THR . 29.0 m -160.19 157.6 28.58 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.857 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.429 ' O ' ' C ' ' A' ' 68' ' ' ASP . 71.2 t80 -110.14 -17.65 13.5 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.67 179.776 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ASP . . . . . 0.443 ' OD2' ' CE2' ' A' ' 81' ' ' TYR . 4.3 t0 35.52 93.56 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.027 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.577 ' O ' ' CD2' ' A' ' 70' ' ' TYR . 4.0 ptmt -52.87 -170.13 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.624 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.577 ' CD2' ' O ' ' A' ' 69' ' ' LYS . 8.1 m-85 83.87 -56.4 0.14 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.837 0.351 . . . . 0.0 110.922 -179.829 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -134.45 17.55 3.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.159 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 45.14 58.68 4.92 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.391 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -89.61 164.86 14.57 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.811 0.339 . . . . 0.0 110.894 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.469 ' HA ' ' O ' ' A' ' 66' ' ' CYS . 0.9 OUTLIER -118.29 90.19 3.28 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.134 179.905 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 16.6 m-30 -97.94 -168.85 1.73 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.861 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.94 162.49 30.54 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.763 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 3.4 t -76.58 -22.92 15.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.134 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -92.18 15.04 63.01 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.566 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -151.53 113.73 4.54 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.771 0.319 . . . . 0.0 110.815 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.812 ' HB ' HG23 ' A' ' 93' ' ' THR . 1.3 t -74.18 179.43 4.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.12 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.734 ' OH ' HG21 ' A' ' 102' ' ' ILE . 45.7 p90 -153.71 168.26 26.84 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.931 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -110.64 144.21 39.89 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.706 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.04 96.02 4.35 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.0 -179.888 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_exo -56.22 138.88 84.8 Favored 'Trans proline' 0 N--CA 1.466 -0.134 0 C-N-CA 122.836 2.357 . . . . 0.0 112.044 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.428 ' O ' ' N ' ' A' ' 87' ' ' SER . 0.2 OUTLIER -155.39 165.11 37.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.917 0.389 . . . . 0.0 111.095 -179.932 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 46.76 -92.7 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.024 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.428 ' N ' ' O ' ' A' ' 85' ' ' LYS . 0.8 OUTLIER -152.16 18.37 0.66 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.969 -179.964 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.408 ' CE ' ' HA ' ' A' ' 88' ' ' MET . 0.6 OUTLIER -147.1 167.45 24.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.878 -179.995 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.411 ' O ' ' N ' ' A' ' 107' ' ' ALA . 4.0 mt -107.39 140.34 26.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.063 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' TRP . . . . . 0.533 ' CD1' ' N ' ' A' ' 90' ' ' TRP . 0.7 OUTLIER -131.86 124.5 29.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.953 -179.868 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -67.1 72.08 0.1 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.742 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' CYS . . . . . 0.48 ' HA ' ' O ' ' A' ' 103' ' ' SER . 54.3 m -59.89 111.83 1.62 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.024 -179.845 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.812 HG23 ' HB ' ' A' ' 80' ' ' THR . 32.2 m -103.79 119.74 39.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.98 179.803 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.818 ' HA ' HD12 ' A' ' 102' ' ' ILE . 0.0 OUTLIER -58.53 80.53 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.832 -179.907 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.467 ' N ' ' O ' ' A' ' 93' ' ' THR . 2.1 mt -98.87 101.05 11.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.312 -179.84 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 144.66 176.19 18.45 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.5 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -69.23 58.82 0.11 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.837 0.351 . . . . 0.0 111.087 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.43 -23.47 15.53 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.559 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -176.58 55.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.846 0.355 . . . . 0.0 110.961 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -89.75 -37.16 6.99 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.39 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.517 ' O ' ' N ' ' A' ' 103' ' ' SER . 2.3 ptp85 -178.58 49.33 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.842 0.353 . . . . 0.0 110.74 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.818 HD12 ' HA ' ' A' ' 94' ' ' CYS . 10.4 mm -38.39 90.48 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.262 -179.903 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.517 ' N ' ' O ' ' A' ' 101' ' ' ARG . 21.9 t -69.08 174.2 4.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.603 179.777 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.451 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 20.1 m -155.76 124.35 5.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.032 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 2.9 p -92.89 104.67 16.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.108 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.507 HG13 ' CZ3' ' A' ' 90' ' ' TRP . 1.3 tt -43.99 151.0 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.083 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.411 ' N ' ' O ' ' A' ' 89' ' ' ILE . . . -121.91 126.25 48.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.063 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 22.1 p30 -147.49 173.14 12.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.888 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.284 -0.865 . . . . 0.0 110.866 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 46.3 p . . . . . 0 N--CA 1.487 1.394 0 CA-C-O 120.81 0.338 . . . . 0.0 111.136 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.407 ' O ' ' O ' ' A' ' 19' ' ' PRO . 3.0 mtmt -115.03 90.93 24.94 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.899 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.407 ' O ' ' O ' ' A' ' 18' ' ' LYS . 69.2 Cg_exo -50.84 -169.08 0.0 OUTLIER 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.739 2.293 . . . . 0.0 112.303 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.18 -167.82 45.91 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.454 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 54.5 m -126.79 132.42 51.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.842 0.353 . . . . 0.0 110.938 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 11.9 t80 -105.98 123.17 47.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.772 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -156.99 134.25 10.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.057 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.465 ' OD1' ' O ' ' A' ' 24' ' ' ASN . 29.8 t30 63.33 11.09 5.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.132 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 97.49 -13.19 64.5 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.8 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.77 146.44 24.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.784 0.326 . . . . 0.0 110.708 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 9.9 t-160 -118.21 90.89 3.43 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.264 -179.67 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -80.91 -165.82 0.99 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.822 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.52 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 0.5 OUTLIER -116.59 158.71 23.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.729 179.799 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.681 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.2 mp -51.98 152.54 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.303 -179.791 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 2.0 m120 55.07 20.49 3.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.162 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.52 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 18.7 tt0 -101.28 152.08 21.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.759 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.421 ' HG2' ' OG1' ' A' ' 46' ' ' THR . 19.9 mt-30 -117.22 145.11 44.11 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.021 -179.836 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' TRP . . . . . 0.603 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 38.2 p90 -146.89 177.56 9.03 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.736 179.771 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -107.78 133.33 52.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.285 -179.631 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.436 ' NE ' ' O ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -132.78 -168.83 2.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.449 179.569 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.582 ' HG1' ' C ' ' A' ' 41' ' ' ASN . 1.1 t -158.48 145.4 17.57 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.886 0.374 . . . . 0.0 111.283 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.538 ' CE1' HD13 ' A' ' 39' ' ' LEU . 41.0 t80 -132.77 132.28 42.08 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.655 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.538 HD13 ' CE1' ' A' ' 38' ' ' TYR . 0.5 OUTLIER 57.4 22.36 7.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.563 -179.727 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 81.88 42.69 8.74 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.859 -0.686 . . . . 0.0 112.558 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.582 ' C ' ' HG1' ' A' ' 37' ' ' THR . 83.9 m-20 -143.6 130.95 20.92 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 120.802 0.334 . . . . 0.0 111.137 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.522 ' O ' ' CD1' ' A' ' 43' ' ' LEU . . . -39.34 156.64 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.838 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.522 ' CD1' ' O ' ' A' ' 42' ' ' ALA . 1.4 tp -169.32 160.07 9.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.217 -179.905 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.496 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.9 t -127.29 128.77 70.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.625 179.624 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.603 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 0.8 OUTLIER -114.69 151.39 33.71 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.148 -179.719 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.421 ' OG1' ' HG2' ' A' ' 33' ' ' GLN . 29.3 m -135.61 133.75 38.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.054 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.524 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 28.4 t -85.7 160.86 19.44 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.813 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.514 ' CB ' ' HB3' ' A' ' 52' ' ' ARG . 75.1 m-85 -133.36 -39.65 0.91 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.943 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.475 ' O ' ' N ' ' A' ' 51' ' ' SER . . . 154.74 45.52 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.5 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 64.52 -69.32 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.44 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.475 ' N ' ' O ' ' A' ' 49' ' ' GLY . 12.2 m -63.86 -48.06 78.25 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.805 0.336 . . . . 0.0 110.847 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.514 ' HB3' ' CB ' ' A' ' 48' ' ' TYR . 0.2 OUTLIER -56.63 -23.36 40.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.865 179.9 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLY . . . . . 0.495 ' O ' ' CD1' ' A' ' 48' ' ' TYR . . . 68.98 145.43 0.16 Allowed Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.594 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.569 ' CE1' ' SG ' ' A' ' 45' ' ' CYS . 13.1 p90 -86.73 170.05 12.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.872 0.368 . . . . 0.0 110.798 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.431 ' O ' ' HA ' ' A' ' 45' ' ' CYS . 39.5 m-20 -141.0 138.28 33.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.728 179.857 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.496 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.5 OUTLIER -117.83 159.97 22.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.105 -179.846 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.454 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.6 pm0 -168.42 172.14 8.55 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.865 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.514 ' HA ' HD12 ' A' ' 43' ' ' LEU . 0.9 OUTLIER -76.5 152.27 36.14 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.872 -179.999 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -45.33 116.51 3.07 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.953 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -50.66 -23.31 10.9 Favored 'Trans proline' 0 C--O 1.231 0.159 0 C-N-CA 122.719 2.279 . . . . 0.0 112.344 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.459 ' O ' ' O ' ' A' ' 62' ' ' ALA . 0.7 OUTLIER -70.7 58.0 0.2 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.939 -179.993 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.459 ' O ' ' O ' ' A' ' 61' ' ' GLU . . . 42.21 -168.96 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.014 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -74.25 -27.37 60.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.483 179.751 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.504 ' CB ' HG12 ' A' ' 77' ' ' VAL . 1.6 mp0 -81.24 156.68 25.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.789 179.831 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.459 ' OG1' ' N ' ' A' ' 66' ' ' CYS . 2.6 t 175.37 177.97 0.17 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.996 0.427 . . . . 0.0 111.378 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.459 ' N ' ' OG1' ' A' ' 65' ' ' THR . 0.1 OUTLIER 175.11 -162.34 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.727 -179.989 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.479 ' HA ' ' O ' ' A' ' 73' ' ' ASN . 68.9 t80 -170.07 -38.73 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.045 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 4.6 t70 49.98 88.11 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.757 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.453 ' C ' ' CG ' ' A' ' 70' ' ' TYR . 1.8 mtmt -59.31 159.5 7.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.89 -179.876 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.453 ' CG ' ' C ' ' A' ' 69' ' ' LYS . 1.0 OUTLIER 77.68 17.35 1.4 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.008 179.981 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 2.9 m -162.86 -44.93 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.234 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 77.0 75.33 0.92 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.581 -0.818 . . . . 0.0 112.49 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ASN . . . . . 0.479 ' O ' ' HA ' ' A' ' 67' ' ' PHE . 3.0 m120 -129.42 -172.29 2.71 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.88 0.371 . . . . 0.0 110.808 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 1.3 m -146.8 100.85 3.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.022 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.41 ' N ' ' CD1' ' A' ' 75' ' ' TYR . 3.6 m-30 -92.85 -160.54 0.76 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.81 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ARG . . . . . 0.456 ' O ' ' C ' ' A' ' 77' ' ' VAL . 0.4 OUTLIER -142.85 60.51 1.42 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.785 179.825 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.783 ' O ' HG22 ' A' ' 77' ' ' VAL . 6.6 p 29.32 44.71 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.62 179.807 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -160.41 41.55 0.44 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.508 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -160.75 109.06 1.6 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.775 0.321 . . . . 0.0 110.861 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 1.1 t -96.15 172.44 7.98 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.113 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 42.2 p90 -165.54 -174.04 2.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.829 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 -114.77 126.07 54.42 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.832 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 5.0 ttm180 -130.77 90.99 38.45 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.129 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -57.33 120.46 8.39 Favored 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.744 2.296 . . . . 0.0 112.061 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.6 tptp -126.08 146.26 50.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.013 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 60.74 -84.66 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.934 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.1 p -155.81 21.47 0.39 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.017 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 1.8 ttt -144.55 164.71 30.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.881 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.495 ' C ' ' CD1' ' A' ' 90' ' ' TRP . 2.2 mt -99.42 150.99 4.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.139 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' TRP . . . . . 0.584 ' CE3' ' HA ' ' A' ' 106' ' ' ILE . 4.5 m95 -147.08 120.72 9.15 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.867 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -70.82 58.49 0.21 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.985 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' CYS . . . . . 0.418 ' HA ' ' HA ' ' A' ' 104' ' ' CYS . 84.5 m -45.4 136.24 5.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.871 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 40.9 m -122.72 139.25 54.17 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.146 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.42 ' O ' ' HA ' ' A' ' 77' ' ' VAL . 30.8 t -69.95 68.2 0.29 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.848 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.735 HG22 ' CA ' ' A' ' 100' ' ' GLY . 2.6 mt -77.88 123.21 34.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.276 -179.846 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.68 ' O ' ' HB3' ' A' ' 97' ' ' ALA . . . -145.28 -151.52 5.43 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.515 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.68 ' HB3' ' O ' ' A' ' 96' ' ' GLY . . . 85.17 72.49 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.807 0.337 . . . . 0.0 111.136 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 92.04 -59.27 2.77 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.515 -179.883 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.446 ' O ' ' HD2' ' A' ' 101' ' ' ARG . 0.0 OUTLIER -163.82 56.96 0.17 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.865 0.364 . . . . 0.0 110.97 -179.966 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 0.735 ' CA ' HG22 ' A' ' 95' ' ' ILE . . . -80.88 -40.1 12.48 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.435 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.458 ' O ' ' O ' ' A' ' 100' ' ' GLY . 0.0 OUTLIER 55.15 115.89 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.833 0.349 . . . . 0.0 110.863 -179.941 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.586 ' N ' HD13 ' A' ' 102' ' ' ILE . 2.2 mm -44.98 94.36 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.121 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.419 ' N ' ' O ' ' A' ' 101' ' ' ARG . 15.5 t -76.65 149.37 36.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.909 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.418 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 92.5 m -132.75 102.69 5.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.961 -179.946 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 14.8 t -84.81 143.0 29.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.061 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.584 ' HA ' ' CE3' ' A' ' 90' ' ' TRP . 7.3 tt -70.94 140.36 18.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.053 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -103.97 145.54 29.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.115 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -125.18 14.26 8.37 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.955 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 3.1 ttp180 . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.263 -0.875 . . . . 0.0 110.899 -179.95 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 58.4 p . . . . . 0 N--CA 1.485 1.323 0 CA-C-O 120.819 0.342 . . . . 0.0 111.232 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.413 ' HB2' ' HD2' ' A' ' 19' ' ' PRO . 0.0 OUTLIER -159.83 156.63 24.68 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.921 179.988 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.413 ' HD2' ' HB2' ' A' ' 18' ' ' LYS . 68.8 Cg_endo -74.45 -162.92 0.16 Allowed 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.785 2.323 . . . . 0.0 112.391 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.449 ' HA2' HG13 ' A' ' 30' ' ' ILE . . . 67.68 -143.64 42.41 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.526 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -159.68 52.41 0.35 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.861 0.362 . . . . 0.0 110.954 -179.92 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.576 ' CD1' ' HB2' ' A' ' 27' ' ' HIS . 0.4 OUTLIER -47.88 102.78 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.886 -179.987 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -77.95 -167.24 0.95 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.846 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -43.07 -54.86 4.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.886 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -140.98 8.25 2.71 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.472 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.531 ' HB3' ' CE1' ' A' ' 28' ' ' TYR . 0.1 OUTLIER -127.94 131.47 49.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.79 0.328 . . . . 0.0 110.816 179.988 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 27' ' ' HIS . . . . . 0.576 ' HB2' ' CD1' ' A' ' 22' ' ' TYR . 0.7 OUTLIER -117.52 88.67 2.96 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.034 -179.766 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.531 ' CE1' ' HB3' ' A' ' 26' ' ' LYS . 6.9 m-85 -79.68 161.71 25.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.888 179.864 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.532 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 4.0 mt-30 -84.73 137.4 33.24 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.618 179.721 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.668 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.9 mp -37.83 147.28 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 120.904 0.383 . . . . 0.0 111.189 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.471 ' HB2' ' O ' ' A' ' 30' ' ' ILE . 26.5 m-80 67.29 11.89 8.63 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.157 179.76 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.532 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 41.7 tt0 -100.33 144.55 29.2 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.785 0.326 . . . . 0.0 110.771 179.726 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 13.2 mt-30 -111.74 156.63 21.6 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.003 0.43 . . . . 0.0 111.278 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' TRP . . . . . 0.505 ' CZ3' ' HB2' ' A' ' 47' ' ' CYS . 48.3 p90 -163.06 162.67 25.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.641 179.836 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -106.5 124.86 50.23 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.938 0.399 . . . . 0.0 111.1 -179.725 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.485 ' N ' ' O ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -123.52 -169.95 2.03 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.595 179.642 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.3 t -150.26 131.49 14.53 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.161 179.885 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.607 ' HB2' HD22 ' A' ' 43' ' ' LEU . 20.2 t80 -121.77 139.85 53.08 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.506 179.752 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.453 HD13 ' HE1' ' A' ' 38' ' ' TYR . 0.4 OUTLIER 55.88 20.03 3.91 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.943 0.401 . . . . 0.0 110.387 -179.701 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 78.52 46.21 9.02 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.944 -0.646 . . . . 0.0 112.617 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.425 ' O ' ' C ' ' A' ' 42' ' ' ALA . 14.5 m120 -151.32 132.21 14.19 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.808 0.337 . . . . 0.0 110.969 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.425 ' C ' ' O ' ' A' ' 41' ' ' ASN . . . -36.04 147.59 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.982 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.607 HD22 ' HB2' ' A' ' 38' ' ' TYR . 1.8 tp -159.53 147.28 17.2 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.07 -179.842 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.507 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 3.2 t -122.21 131.56 72.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.6 179.7 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.57 ' SG ' ' CD1' ' A' ' 54' ' ' PHE . 0.8 OUTLIER -117.47 152.42 35.07 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.268 -179.678 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.455 ' O ' ' CE1' ' A' ' 48' ' ' TYR . 88.4 m -138.78 112.76 8.53 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.02 179.83 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.505 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 8.7 t -77.05 134.58 38.74 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.947 179.898 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.466 ' O ' ' CG2' ' A' ' 30' ' ' ILE . 2.0 m-85 -106.84 -45.34 4.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.926 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.576 ' CA ' HG23 ' A' ' 30' ' ' ILE . . . 117.89 -172.52 14.42 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.508 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 41.42 -112.11 0.35 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.571 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -110.64 -21.15 12.26 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.799 0.333 . . . . 0.0 111.017 -179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 3.8 mtt180 -47.6 -29.84 3.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.824 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 64.6 -124.67 29.63 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.599 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.57 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 8.1 p90 -155.98 155.04 32.06 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.83 0.348 . . . . 0.0 110.864 -179.817 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -124.43 132.63 53.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.719 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.507 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.1 OUTLIER -112.42 160.96 17.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.114 -179.915 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 178.36 171.93 0.72 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.917 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 79.1 p -59.44 116.16 3.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.931 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.417 ' C ' ' HD3' ' A' ' 59' ' ' LYS . 0.0 OUTLIER -46.76 136.37 7.77 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.973 179.922 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -46.04 124.39 7.31 Favored 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.758 2.305 . . . . 0.0 112.427 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.17 -52.21 9.05 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.921 -179.866 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.714 ' HB1' ' CB ' ' A' ' 97' ' ' ALA . . . -165.28 133.81 3.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.152 -179.935 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -60.48 169.0 1.88 Allowed 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.146 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -106.06 79.23 1.38 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.806 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.495 ' OG1' ' N ' ' A' ' 66' ' ' CYS . 0.1 OUTLIER -168.9 174.41 6.46 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.185 -179.948 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.495 ' N ' ' OG1' ' A' ' 65' ' ' THR . 1.6 p 173.93 105.06 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.856 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.401 ' CE1' ' HA2' ' A' ' 72' ' ' GLY . 85.3 t80 -62.36 117.46 6.16 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.91 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ASP . . . . . 0.489 ' HB2' ' O ' ' A' ' 73' ' ' ASN . 6.1 t0 -89.14 78.87 7.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.865 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.417 ' C ' ' O ' ' A' ' 68' ' ' ASP . 9.4 pttp -36.08 -31.55 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.849 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.473 ' N ' ' O ' ' A' ' 68' ' ' ASP . 5.2 m-85 -40.79 -56.16 2.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.965 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 12.8 t -126.8 -36.21 2.23 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.166 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' GLY . . . . . 0.401 ' HA2' ' CE1' ' A' ' 67' ' ' PHE . . . 125.11 10.6 4.62 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.53 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ASN . . . . . 0.489 ' O ' ' HB2' ' A' ' 68' ' ' ASP . 20.8 m120 -97.06 140.25 31.85 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.827 0.346 . . . . 0.0 110.848 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 4.1 t -103.92 140.96 36.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.084 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -126.42 -178.62 4.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.797 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -78.48 124.73 28.46 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.87 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.477 HG13 ' N ' ' A' ' 78' ' ' GLY . 8.9 p -46.43 -42.68 5.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.175 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.477 ' N ' HG13 ' A' ' 77' ' ' VAL . . . -86.85 38.34 3.13 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.496 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -123.34 139.52 53.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.814 0.34 . . . . 0.0 110.894 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 24.1 p -111.99 109.32 19.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.093 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.415 ' C ' ' OD1' ' A' ' 91' ' ' ASP . 6.4 p90 -121.04 143.34 49.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.834 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.412 ' HA ' ' HA ' ' A' ' 91' ' ' ASP . 50.0 mt-10 -85.15 175.08 9.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.928 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.443 ' HA ' ' HD2' ' A' ' 84' ' ' PRO . 0.0 OUTLIER -164.98 111.12 0.83 Allowed Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.792 179.952 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.443 ' HD2' ' HA ' ' A' ' 83' ' ' ARG . 25.0 Cg_endo -62.2 137.38 65.78 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.718 2.278 . . . . 0.0 112.277 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -171.77 132.41 0.72 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.901 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 54.71 -160.36 0.16 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.911 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.2 p -89.64 33.71 0.84 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.87 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.506 ' O ' ' NE1' ' A' ' 90' ' ' TRP . 2.6 ttm -162.71 129.54 3.57 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.823 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 1.3 mt -91.67 133.6 32.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.205 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' TRP . . . . . 0.995 ' CZ3' HD11 ' A' ' 106' ' ' ILE . 0.0 OUTLIER -127.5 123.44 35.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.912 179.891 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.415 ' OD1' ' C ' ' A' ' 81' ' ' TYR . 41.8 t0 -76.61 102.02 5.96 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.931 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' CYS . . . . . 0.5 ' HA ' ' HA ' ' A' ' 104' ' ' CYS . 1.1 m -81.21 117.48 21.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.01 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 30.3 m -88.33 127.64 35.48 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.018 179.799 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.404 ' O ' ' HA ' ' A' ' 77' ' ' VAL . 0.1 OUTLIER -68.22 86.2 0.27 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.914 -179.919 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 1.2 mt -99.33 61.58 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.352 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.44 ' O ' ' HB3' ' A' ' 97' ' ' ALA . . . -96.71 -114.27 3.07 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.549 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.714 ' CB ' ' HB1' ' A' ' 62' ' ' ALA . . . 68.08 20.75 8.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.95 0.405 . . . . 0.0 111.112 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 156.02 -52.58 0.43 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.722 -0.752 . . . . 0.0 112.327 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.438 ' CG ' ' O ' ' A' ' 99' ' ' ARG . 0.0 OUTLIER -133.12 94.12 3.3 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.826 0.346 . . . . 0.0 110.873 179.993 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -36.72 98.35 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.835 -0.698 . . . . 0.0 112.552 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -117.66 48.95 1.28 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.756 0.313 . . . . 0.0 110.813 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.576 ' H ' HD12 ' A' ' 102' ' ' ILE . 2.2 mp -56.22 102.55 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.192 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 32.5 t -98.6 129.42 45.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.738 179.841 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.5 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 0.7 OUTLIER -99.53 148.41 24.3 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.97 0.414 . . . . 0.0 111.033 -179.888 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -157.05 112.48 2.85 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.061 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.995 HD11 ' CZ3' ' A' ' 90' ' ' TRP . 3.3 mp -40.3 131.95 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.173 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -96.27 108.56 21.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.083 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 3.8 p30 -132.08 36.21 3.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.906 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 9.2 mtp85 . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.945 -179.955 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 12.9 t . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.794 0.331 . . . . 0.0 111.22 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 9.3 mtmt 63.81 147.53 0.1 OUTLIER Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.992 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -65.8 173.55 6.74 Favored 'Trans proline' 0 C--O 1.231 0.163 0 C-N-CA 122.751 2.301 . . . . 0.0 112.275 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 95.4 177.76 37.18 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.384 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 69.6 m -112.58 126.58 55.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.81 0.338 . . . . 0.0 110.877 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 15.0 t80 -119.39 121.47 39.6 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.975 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.423 ' O ' ' C ' ' A' ' 24' ' ' ASN . 2.0 t0 -99.33 -162.5 0.96 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.942 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.423 ' C ' ' O ' ' A' ' 23' ' ' ASP . 7.9 t-20 -35.81 -53.14 0.73 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.954 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -153.64 20.76 0.7 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.588 -179.895 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.42 ' HB3' ' CE2' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -121.41 132.66 54.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.889 0.376 . . . . 0.0 110.952 179.868 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 13.5 t-160 -115.0 91.56 3.65 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.096 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.463 ' HB3' ' OE1' ' A' ' 32' ' ' GLN . 0.1 OUTLIER -83.15 -178.39 7.09 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.929 179.915 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.524 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 1.7 tt0 -114.21 152.41 31.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.548 179.636 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.688 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.4 mp -49.47 154.03 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.153 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 10.7 m-20 59.53 17.95 6.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.02 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.524 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 2.2 tt0 -105.25 142.54 34.84 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.81 179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.428 ' CG ' HG23 ' A' ' 46' ' ' THR . 24.9 mt-30 -115.93 140.71 48.97 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.05 -179.76 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' TRP . . . . . 0.604 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 39.6 p90 -148.5 -173.34 4.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.807 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.671 ' OE2' ' HB1' ' A' ' 42' ' ' ALA . 61.6 tt0 -120.01 121.67 39.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.925 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.844 ' O ' HD22 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -106.81 156.45 18.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.821 179.982 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.3 m -110.09 139.43 45.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.678 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.491 ' N ' HD21 ' A' ' 43' ' ' LEU . 1.0 OUTLIER -155.2 110.65 3.07 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.783 179.827 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 66.56 38.2 4.22 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.613 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 65.31 44.85 92.91 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.446 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.502 ' HB2' HD11 ' A' ' 43' ' ' LEU . 46.4 m-80 -135.78 175.09 9.91 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 120.811 0.338 . . . . 0.0 110.933 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.932 ' C ' HD13 ' A' ' 43' ' ' LEU . . . -117.1 104.15 10.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.905 179.834 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.932 HD13 ' C ' ' A' ' 42' ' ' ALA . 0.0 OUTLIER -114.73 118.92 34.98 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.25 -179.786 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.481 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.7 t -71.13 128.48 34.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.369 179.368 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.604 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 1.9 m -106.17 157.82 17.28 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.148 -179.598 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.443 ' O ' ' CE1' ' A' ' 48' ' ' TYR . 8.6 m -146.63 121.51 9.97 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.083 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.477 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 18.3 t -79.95 134.29 36.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.97 -179.826 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.481 ' HB2' ' HB3' ' A' ' 52' ' ' ARG . 1.4 m-85 -104.95 -45.94 4.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.983 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 114.13 -173.86 15.19 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.423 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 39.81 -129.92 2.54 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.535 179.918 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 18.0 m -102.27 26.13 8.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.767 0.318 . . . . 0.0 110.964 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.481 ' HB3' ' HB2' ' A' ' 48' ' ' TYR . 9.0 mmt180 -87.57 -47.24 8.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.173 -179.846 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 65.3 160.77 0.62 Allowed Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.507 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.573 ' CE1' ' SG ' ' A' ' 45' ' ' CYS . 0.6 OUTLIER -73.99 149.95 41.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.822 0.344 . . . . 0.0 110.835 -179.993 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -112.38 -45.86 3.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.966 -179.846 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.481 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.1 OUTLIER 72.39 146.16 0.08 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.889 -179.966 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.408 ' CG ' ' N ' ' A' ' 58' ' ' SER . 0.9 OUTLIER -124.48 -89.94 0.57 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.933 179.958 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.497 ' HA ' ' HA ' ' A' ' 43' ' ' LEU . 67.4 m -165.45 177.34 7.54 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.713 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.486 ' HB2' ' HB3' ' A' ' 42' ' ' ALA . 0.7 OUTLIER -75.53 109.14 7.05 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.793 179.983 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.47 ' HD3' ' O ' ' A' ' 58' ' ' SER . 57.6 Cg_endo -71.12 -178.16 2.71 Favored 'Trans proline' 0 C--O 1.231 0.149 0 C-N-CA 122.751 2.301 . . . . 0.0 112.445 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -143.77 57.48 1.35 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.739 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . 56.0 -169.98 0.08 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.071 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.421 ' HG3' ' N ' ' A' ' 64' ' ' GLU . 1.1 tt0 -109.75 150.12 28.8 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.592 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.421 ' N ' ' HG3' ' A' ' 63' ' ' GLU . 16.8 tt0 -127.13 51.18 1.91 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.964 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -165.91 143.64 5.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.114 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 5.1 m -124.59 -172.17 2.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.766 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.565 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 87.8 t80 -161.78 118.59 2.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.067 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ASP . . . . . 0.428 ' O ' ' C ' ' A' ' 69' ' ' LYS . 3.7 t0 -92.22 76.79 5.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.728 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.565 ' HA ' ' CE2' ' A' ' 67' ' ' PHE . 1.3 ptmt -35.18 -35.85 0.05 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.984 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.418 ' N ' ' O ' ' A' ' 68' ' ' ASP . 18.6 m-30 -40.29 -57.24 1.79 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.911 179.875 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 20.5 p -140.48 32.33 1.87 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.105 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 46.36 95.45 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.54 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ASN . . . . . 0.477 ' O ' ' HA ' ' A' ' 67' ' ' PHE . 2.0 m-80 -147.18 162.88 37.98 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.792 0.33 . . . . 0.0 110.983 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -132.87 104.59 6.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.154 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.592 ' CD2' ' CE1' ' A' ' 81' ' ' TYR . 0.7 OUTLIER -108.45 13.54 25.38 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.882 -179.926 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ARG . . . . . 0.427 ' O ' ' O ' ' A' ' 75' ' ' TYR . 70.9 mtt85 49.15 178.71 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.767 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.703 ' O ' HG22 ' A' ' 77' ' ' VAL . 12.2 p -95.53 28.17 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.153 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -146.44 14.15 1.61 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.424 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -134.01 127.53 32.49 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.811 0.338 . . . . 0.0 111.02 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.654 HG22 ' CG2' ' A' ' 93' ' ' THR . 22.2 p -92.51 164.16 13.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.118 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.592 ' CE1' ' CD2' ' A' ' 75' ' ' TYR . 47.9 p90 -158.55 166.1 32.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.92 -179.927 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -117.18 116.32 27.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.804 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 20.8 mmt-85 -118.23 117.05 35.24 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.946 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -71.96 106.94 2.11 Favored 'Trans proline' 0 C--N 1.342 0.222 0 C-N-CA 122.7 2.267 . . . . 0.0 112.291 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.463 ' O ' ' CB ' ' A' ' 86' ' ' ASP . 1.5 mmpp? -117.61 107.87 14.76 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.876 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.463 ' CB ' ' O ' ' A' ' 85' ' ' LYS . 0.4 OUTLIER 81.85 -153.7 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.801 -179.965 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -81.11 6.95 12.2 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.067 179.904 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 1.4 tpt -137.92 149.22 46.01 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.861 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.53 ' C ' ' CD1' ' A' ' 90' ' ' TRP . 1.4 mt -110.36 154.2 11.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.198 -179.958 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' TRP . . . . . 0.631 ' CD1' ' N ' ' A' ' 90' ' ' TRP . 0.1 OUTLIER -143.23 150.04 38.77 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.776 179.912 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.451 ' OD1' ' HB3' ' A' ' 108' ' ' ASN . 0.2 OUTLIER -83.28 65.38 8.25 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.957 179.979 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 92' ' ' CYS . . . . . 0.41 ' HA ' ' HA ' ' A' ' 104' ' ' CYS . 21.4 m -48.12 137.14 10.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.111 179.928 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.654 ' CG2' HG22 ' A' ' 80' ' ' THR . 18.3 m -145.08 137.52 26.04 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.068 179.878 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.404 ' HB2' ' CD1' ' A' ' 75' ' ' TYR . 5.1 t -74.42 71.82 1.81 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.942 -179.827 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.51 HG22 ' O ' ' A' ' 95' ' ' ILE . 2.3 mt -81.25 66.66 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.296 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.638 ' O ' ' HB3' ' A' ' 97' ' ' ALA . . . 153.1 -83.24 0.16 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.375 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.638 ' HB3' ' O ' ' A' ' 96' ' ' GLY . . . 80.18 80.71 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.803 0.335 . . . . 0.0 111.137 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.54 0.02 86.58 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.589 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 17.9 mtp85 -139.73 -55.53 0.56 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.814 0.34 . . . . 0.0 110.981 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 0.427 ' O ' ' HB3' ' A' ' 101' ' ' ARG . . . -85.61 -103.96 0.7 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.473 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.427 ' HB3' ' O ' ' A' ' 100' ' ' GLY . 0.0 OUTLIER 179.73 169.51 1.15 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.766 0.317 . . . . 0.0 110.895 -179.925 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 3.7 mt -97.1 64.77 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.079 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 19.2 t -45.42 155.95 0.13 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.852 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.41 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 81.1 m -150.97 96.36 2.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.945 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' THR . . . . . 0.441 ' O ' ' N ' ' A' ' 91' ' ' ASP . 0.1 OUTLIER -91.37 150.89 21.08 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.129 -179.965 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.498 HG13 ' CE3' ' A' ' 90' ' ' TRP . 2.3 mp -65.79 144.5 14.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.048 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . 43.64 -163.9 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.086 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' ASN . . . . . 0.464 ' OD1' ' N ' ' A' ' 108' ' ' ASN . 4.7 p-10 -146.95 157.25 43.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.83 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' ARG . . . . . 0.448 ' HG2' ' O ' ' A' ' 108' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.959 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 23.3 t . . . . . 0 N--CA 1.486 1.331 0 CA-C-O 120.843 0.354 . . . . 0.0 111.218 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -143.83 109.74 5.16 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.899 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -78.06 159.86 30.26 Favored 'Trans proline' 0 N--CA 1.464 -0.263 0 C-N-CA 122.812 2.341 . . . . 0.0 112.312 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.58 ' HA3' ' CE1' ' A' ' 27' ' ' HIS . . . 138.36 -151.72 21.63 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.665 -0.779 . . . . 0.0 112.615 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -158.07 64.83 0.45 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.852 0.358 . . . . 0.0 110.831 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -45.46 137.89 4.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.841 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -162.99 119.82 1.88 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.891 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.404 ' O ' ' CG ' ' A' ' 24' ' ' ASN . 36.6 t30 54.79 30.4 13.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.919 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 85.64 -10.33 65.11 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.539 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.84 128.19 39.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.813 0.34 . . . . 0.0 110.862 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' HIS . . . . . 0.58 ' CE1' ' HA3' ' A' ' 20' ' ' GLY . 34.1 t60 -115.28 94.26 4.65 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.193 -179.706 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -81.71 -168.97 2.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.803 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.531 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 43.1 tt0 -106.01 141.41 37.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.851 179.862 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.694 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.6 mp -48.97 146.14 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.252 -179.859 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.405 ' OD1' HG22 ' A' ' 30' ' ' ILE . 0.6 OUTLIER 67.5 12.64 9.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.901 -179.998 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.531 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 52.6 tt0 -98.65 151.63 20.49 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.637 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 18.9 mt-30 -114.57 152.35 31.92 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.096 -179.836 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' TRP . . . . . 0.56 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 43.4 p90 -153.05 179.08 9.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.78 179.783 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -109.74 127.73 54.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.866 0.365 . . . . 0.0 111.305 -179.662 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.521 ' O ' ' N ' ' A' ' 43' ' ' LEU . 39.5 ttt-85 -133.4 171.67 13.74 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.341 179.631 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.433 ' HG1' ' C ' ' A' ' 41' ' ' ASN . 1.5 t -135.29 139.88 44.71 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.782 0.325 . . . . 0.0 111.352 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.487 ' HB2' HD22 ' A' ' 43' ' ' LEU . 3.6 t80 -126.79 126.61 43.7 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.638 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.456 HD13 ' HA ' ' A' ' 39' ' ' LEU . 2.9 mm? 63.11 25.78 15.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.574 -179.734 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 76.22 43.07 21.97 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 121.041 -0.599 . . . . 0.0 112.667 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.433 ' C ' ' HG1' ' A' ' 37' ' ' THR . 75.9 m-20 -145.56 129.86 17.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.796 0.331 . . . . 0.0 111.074 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.429 ' C ' ' O ' ' A' ' 41' ' ' ASN . . . -37.5 153.98 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.458 179.687 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.521 ' N ' ' O ' ' A' ' 36' ' ' ARG . 4.4 tp -169.52 161.34 9.59 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.082 0.468 . . . . 0.0 111.618 -179.527 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.492 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 19.6 t -124.36 155.88 32.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.232 179.267 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.57 ' SG ' ' CD1' ' A' ' 54' ' ' PHE . 0.5 OUTLIER -139.46 150.46 45.22 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.939 0.4 . . . . 0.0 111.423 -179.618 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 97.9 m -133.89 115.98 15.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.811 179.8 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.507 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 36.9 t -71.73 156.35 39.44 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.971 -179.844 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.524 ' O ' ' CG2' ' A' ' 30' ' ' ILE . 42.3 m-85 -119.25 -53.28 2.25 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.151 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.495 ' HA2' HG23 ' A' ' 30' ' ' ILE . . . 156.82 52.49 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.456 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 48.63 50.21 25.69 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.526 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -149.4 -61.6 0.22 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.832 0.349 . . . . 0.0 110.842 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.524 ' NE ' ' HA ' ' A' ' 52' ' ' ARG . 8.5 mmm180 -68.46 -31.6 71.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.781 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLY . . . . . 0.577 ' O ' ' CD2' ' A' ' 54' ' ' PHE . . . 88.02 24.3 35.33 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 120.881 -0.676 . . . . 0.0 112.533 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.577 ' CD2' ' O ' ' A' ' 53' ' ' GLY . 1.5 p90 56.04 151.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.943 0.402 . . . . 0.0 111.106 179.839 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.401 ' O ' ' OD1' ' A' ' 55' ' ' ASN . 43.6 p-10 -130.44 109.38 10.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.64 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.492 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.7 OUTLIER -83.73 170.06 14.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.103 -179.855 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 172.31 166.76 0.11 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.963 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.438 ' HA ' HD12 ' A' ' 43' ' ' LEU . 5.0 t -58.6 154.68 13.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.951 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.438 ' HG3' ' HD2' ' A' ' 60' ' ' PRO . 0.0 OUTLIER -79.97 131.89 62.04 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.835 -179.975 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.438 ' HD2' ' HG3' ' A' ' 59' ' ' LYS . 36.2 Cg_endo -65.31 -12.75 36.34 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.686 2.257 . . . . 0.0 112.264 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 10.5 tt0 38.86 46.29 1.05 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.936 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -119.14 166.69 12.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.177 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.522 ' OE2' ' HB2' ' A' ' 97' ' ' ALA . 0.8 OUTLIER -115.8 -21.42 9.61 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.503 -179.931 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.515 ' CB ' HG21 ' A' ' 77' ' ' VAL . 0.1 OUTLIER 179.5 -166.38 0.07 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.894 -179.968 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.422 HG23 ' C ' ' A' ' 64' ' ' GLU . 30.5 p -158.02 146.03 18.66 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.215 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.623 ' O ' HG23 ' A' ' 74' ' ' THR . 25.9 p -121.43 -175.81 3.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.788 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.529 ' CE1' ' HA2' ' A' ' 72' ' ' GLY . 76.6 t80 -137.78 127.79 25.77 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.922 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 33.3 t0 -92.1 92.64 8.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.909 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.476 ' HA ' ' CE2' ' A' ' 67' ' ' PHE . 0.8 OUTLIER -47.79 -25.44 1.27 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.005 -179.967 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.418 ' C ' ' O ' ' A' ' 69' ' ' LYS . 8.2 m-30 -36.27 -59.37 0.63 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.829 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -159.77 30.51 0.19 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.15 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' GLY . . . . . 0.529 ' HA2' ' CE1' ' A' ' 67' ' ' PHE . . . 71.88 74.48 0.74 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.674 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -138.45 90.83 2.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.723 0.297 . . . . 0.0 110.714 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.623 HG23 ' O ' ' A' ' 66' ' ' CYS . 34.0 m -69.11 137.32 53.34 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.146 -179.97 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.441 ' CD2' ' CE1' ' A' ' 81' ' ' TYR . 66.3 m-85 -126.95 155.55 42.93 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.794 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 11.5 mtp180 -84.22 127.82 34.19 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.917 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.515 HG21 ' CB ' ' A' ' 64' ' ' GLU . 43.0 t -44.72 -27.03 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.108 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -90.08 26.71 9.38 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.589 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -158.39 134.88 9.47 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.826 0.346 . . . . 0.0 111.0 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 5.3 t -111.17 165.28 12.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.905 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.441 ' CE1' ' CD2' ' A' ' 75' ' ' TYR . 19.1 p90 -143.73 173.86 11.31 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.892 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -148.46 110.76 4.65 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.773 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.3 143.56 47.63 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.963 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -68.09 139.0 45.31 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.84 2.36 . . . . 0.0 112.29 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.431 ' O ' ' O ' ' A' ' 88' ' ' MET . 0.1 OUTLIER -160.47 133.58 6.63 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.899 179.943 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.404 ' O ' ' OG ' ' A' ' 87' ' ' SER . 0.9 OUTLIER 56.48 52.16 10.31 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.906 179.989 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.404 ' OG ' ' O ' ' A' ' 86' ' ' ASP . 1.8 p 53.38 23.16 3.17 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.878 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.431 ' O ' ' O ' ' A' ' 85' ' ' LYS . 0.2 OUTLIER -150.49 143.67 24.88 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.915 179.925 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 4.4 mt -108.5 136.53 43.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.166 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' TRP . . . . . 0.796 ' CZ3' HD11 ' A' ' 106' ' ' ILE . 0.1 OUTLIER -131.18 140.86 49.98 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.74 179.955 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -79.57 52.67 1.44 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.699 179.887 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' CYS . . . . . 0.462 ' HA ' ' HA ' ' A' ' 104' ' ' CYS . 70.9 m -41.43 111.29 0.21 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.087 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.486 ' O ' ' N ' ' A' ' 95' ' ' ILE . 51.9 m -98.34 132.87 43.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.894 179.83 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 43.5 t -65.89 61.98 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.935 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.486 ' N ' ' O ' ' A' ' 93' ' ' THR . 2.5 mt -69.62 105.23 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.205 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.434 ' O ' ' HB3' ' A' ' 97' ' ' ALA . . . -142.56 -119.23 1.43 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.635 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.522 ' HB2' ' OE2' ' A' ' 63' ' ' GLU . . . 67.47 -74.35 0.07 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.831 0.348 . . . . 0.0 110.981 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -128.64 80.41 0.36 Allowed Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.827 -0.702 . . . . 0.0 112.318 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 2.2 mtt-85 62.75 13.35 6.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.811 0.339 . . . . 0.0 110.675 -179.795 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 0.485 ' CA ' HG22 ' A' ' 95' ' ' ILE . . . -43.72 -52.09 6.66 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.601 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.449 ' HB3' ' O ' ' A' ' 100' ' ' GLY . 0.0 OUTLIER 68.39 112.44 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.806 0.336 . . . . 0.0 110.73 -179.945 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.43 ' C ' ' O ' ' A' ' 101' ' ' ARG . 2.3 mp -34.95 151.53 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.224 -179.883 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 4.7 t -146.04 128.91 16.36 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.831 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.462 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 70.9 m -111.66 138.29 48.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.096 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -144.46 140.73 29.12 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.891 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.796 HD11 ' CZ3' ' A' ' 90' ' ' TRP . 2.8 mp -82.0 114.16 22.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.106 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -113.48 143.82 43.87 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.165 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 7.0 p-10 -123.61 115.57 21.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.949 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.248 0.992 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.88 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.401 ' O ' ' C ' ' A' ' 18' ' ' LYS . 4.7 t . . . . . 0 N--CA 1.487 1.405 0 CA-C-O 120.797 0.332 . . . . 0.0 111.165 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.401 ' C ' ' O ' ' A' ' 17' ' ' SER . 0.9 OUTLIER 38.35 71.19 1.12 Allowed Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.868 179.922 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -52.35 142.88 45.78 Favored 'Trans proline' 0 N--CA 1.465 -0.193 0 C-N-CA 122.758 2.305 . . . . 0.0 112.206 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.417 ' C ' ' SG ' ' A' ' 21' ' ' CYS . . . 160.99 -153.26 24.06 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.482 -179.833 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.417 ' SG ' ' C ' ' A' ' 20' ' ' GLY . 0.0 OUTLIER -159.82 93.0 1.06 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.844 0.354 . . . . 0.0 110.828 179.985 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.468 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 6.5 t80 -96.26 101.34 12.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.96 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.494 ' OD2' ' CE2' ' A' ' 54' ' ' PHE . 9.5 t70 -128.4 133.72 48.66 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.858 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 45.6 t30 51.66 28.44 4.77 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.015 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 86.61 -2.22 87.28 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.519 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.592 ' HB3' ' CZ ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -95.7 137.84 34.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.831 0.348 . . . . 0.0 110.95 179.913 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 -114.37 85.76 2.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.906 -179.794 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.592 ' CZ ' ' HB3' ' A' ' 26' ' ' LYS . 2.3 m-85 -79.64 176.48 9.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.961 -179.922 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.513 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 1.2 tt0 -104.09 136.91 42.84 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.56 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.67 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.8 mp -40.76 146.85 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.33 -179.877 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.461 ' HB2' ' O ' ' A' ' 30' ' ' ILE . 30.9 m120 67.9 10.68 7.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.303 179.71 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.513 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 59.9 tt0 -94.62 149.29 21.39 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.806 0.336 . . . . 0.0 110.828 179.79 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.424 ' CG ' HG23 ' A' ' 46' ' ' THR . 19.2 mt-30 -113.38 147.19 38.2 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.209 -179.744 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' TRP . . . . . 0.519 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 42.6 p90 -157.27 -164.45 1.59 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.494 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.64 ' OE1' ' HB1' ' A' ' 42' ' ' ALA . 1.4 tm-20 -128.89 122.73 30.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.86 0.362 . . . . 0.0 111.191 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.666 ' O ' HD22 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -114.92 131.19 56.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.546 179.751 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.4 m -99.83 129.41 45.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.681 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.474 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 1.5 t80 -145.14 112.59 6.18 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.854 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.474 ' HB2' ' O ' ' A' ' 38' ' ' TYR . 0.3 OUTLIER 77.74 56.97 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.658 -179.924 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 48.91 28.94 7.77 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.357 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 34.7 m-80 -140.45 138.85 35.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.795 0.331 . . . . 0.0 110.995 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 1.029 ' C ' HD13 ' A' ' 43' ' ' LEU . . . -87.81 126.43 35.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.169 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 1.029 HD13 ' C ' ' A' ' 42' ' ' ALA . 0.0 OUTLIER -124.34 123.03 39.31 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.306 -0.407 . . . . 0.0 111.175 -179.965 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.48 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.7 t -67.15 133.24 31.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.337 -0.392 . . . . 0.0 109.972 179.17 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.571 ' SG ' ' CD1' ' A' ' 54' ' ' PHE . 1.6 m -115.0 167.35 10.88 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.05 0.452 . . . . 0.0 111.76 -179.037 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.497 ' O ' ' CE1' ' A' ' 48' ' ' TYR . 7.2 m -157.96 118.34 3.39 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.773 -0.648 . . . . 0.0 110.697 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.493 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 12.4 t -78.27 136.05 37.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.207 -179.584 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.501 ' HB2' ' HB2' ' A' ' 52' ' ' ARG . 5.4 m-85 -111.07 -32.29 6.84 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.908 179.848 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 76.6 -170.82 54.98 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.486 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLY . . . . . 0.526 ' O ' ' CB ' ' A' ' 51' ' ' SER . . . 54.4 25.46 34.08 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.522 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.526 ' CB ' ' O ' ' A' ' 50' ' ' GLY . 3.2 m 85.06 -13.29 0.67 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.835 0.35 . . . . 0.0 111.157 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.501 ' HB2' ' HB2' ' A' ' 48' ' ' TYR . 60.7 mtt180 -57.58 -28.85 63.97 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.929 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 58.74 168.65 0.2 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.454 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.571 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 7.6 p90 -84.11 146.66 27.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.765 0.316 . . . . 0.0 110.815 -179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -101.95 -47.82 4.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.018 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.49 ' HA ' ' HA ' ' A' ' 45' ' ' CYS . 0.1 OUTLIER 71.31 159.42 0.21 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.813 -179.881 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.4 ' CG ' ' N ' ' A' ' 58' ' ' SER . 1.5 tp10 -141.65 -93.5 0.14 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.15 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.506 ' HA ' ' HA ' ' A' ' 43' ' ' LEU . 21.7 m -171.63 160.96 5.98 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.88 0.371 . . . . 0.0 111.02 -179.767 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.455 ' HG2' ' HD2' ' A' ' 60' ' ' PRO . 11.7 tmtt? -126.61 133.32 24.88 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.804 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.455 ' HD2' ' HG2' ' A' ' 59' ' ' LYS . 83.2 Cg_exo -44.92 110.98 0.26 Allowed 'Trans proline' 0 N--CA 1.464 -0.261 0 C-N-CA 122.811 2.341 . . . . 0.0 112.399 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -49.69 -22.31 1.32 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.961 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.56 105.29 4.15 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.117 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.447 ' HG3' ' N ' ' A' ' 64' ' ' GLU . 1.9 tt0 -113.38 163.49 14.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.544 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.447 ' N ' ' HG3' ' A' ' 63' ' ' GLU . 13.6 tt0 -169.46 46.07 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.933 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.622 HG22 ' CG2' ' A' ' 74' ' ' THR . 0.0 OUTLIER -142.15 166.5 24.54 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.211 179.907 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.521 ' HA ' ' CA ' ' A' ' 98' ' ' GLY . 3.8 m -149.95 -176.03 5.28 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.917 -179.846 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.577 ' CE2' ' HA2' ' A' ' 72' ' ' GLY . 27.8 t80 -178.61 93.62 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.887 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ASP . . . . . 0.468 ' O ' ' O ' ' A' ' 69' ' ' LYS . 13.6 t70 -93.98 38.18 1.08 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.928 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.471 ' HA ' ' CE1' ' A' ' 67' ' ' PHE . 1.3 pttt 36.6 -159.73 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.953 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.458 ' HB2' ' O ' ' A' ' 69' ' ' LYS . 21.9 m-85 73.32 -54.71 0.69 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.964 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 13.2 p -135.14 12.97 3.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.027 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' GLY . . . . . 0.577 ' HA2' ' CE2' ' A' ' 67' ' ' PHE . . . 46.43 24.63 1.72 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.564 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ASN . . . . . 0.463 ' HB3' ' CE1' ' A' ' 75' ' ' TYR . 1.1 t-20 -72.21 109.6 6.07 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.758 0.314 . . . . 0.0 110.929 -179.933 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.622 ' CG2' HG22 ' A' ' 65' ' ' THR . 92.3 m -78.48 112.11 15.2 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.015 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.659 ' CE2' ' CE2' ' A' ' 81' ' ' TYR . 9.1 m-85 -94.37 -175.77 3.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.898 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ARG . . . . . 0.447 ' HD2' ' HA ' ' A' ' 76' ' ' ARG . 0.2 OUTLIER -104.61 126.46 51.72 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.819 179.991 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.596 HG23 ' N ' ' A' ' 65' ' ' THR . 31.9 t -62.62 -14.94 14.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.213 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -102.39 16.2 55.4 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.475 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -155.69 163.74 39.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.812 0.339 . . . . 0.0 110.922 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.462 HG22 HG23 ' A' ' 93' ' ' THR . 30.6 p -95.99 167.39 11.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.217 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.659 ' CE2' ' CE2' ' A' ' 75' ' ' TYR . 15.6 p90 -146.2 131.68 18.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.858 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.608 ' OE2' HG22 ' A' ' 89' ' ' ILE . 0.8 OUTLIER -70.96 113.32 7.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.02 -179.951 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.511 ' NE ' ' HA ' ' A' ' 83' ' ' ARG . 0.7 OUTLIER -120.71 81.22 32.88 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.768 179.822 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_exo -44.58 116.6 1.15 Allowed 'Trans proline' 0 N--CA 1.465 -0.173 0 C-N-CA 122.877 2.385 . . . . 0.0 112.433 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -132.66 122.11 24.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.897 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 3.7 t0 72.84 -156.53 0.08 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.84 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.17 8.04 12.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.952 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -128.64 160.32 32.8 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.915 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.948 ' O ' HG23 ' A' ' 106' ' ' ILE . 2.6 mp -107.81 128.18 63.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.027 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' TRP . . . . . 0.696 ' CZ3' HD11 ' A' ' 106' ' ' ILE . 1.0 OUTLIER -122.21 136.5 54.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.981 -179.987 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -93.15 57.81 2.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.803 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' CYS . . . . . 0.474 ' HA ' ' HA ' ' A' ' 104' ' ' CYS . 0.7 OUTLIER -38.21 151.63 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.095 -179.94 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.462 HG23 HG22 ' A' ' 80' ' ' THR . 88.7 m -128.2 128.71 45.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.977 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.436 ' HB3' ' HA ' ' A' ' 77' ' ' VAL . 16.2 t -64.66 88.3 0.06 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.01 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.429 ' HB ' ' O ' ' A' ' 101' ' ' ARG . 0.8 OUTLIER -101.8 46.62 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.168 179.998 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 172.64 -159.6 30.37 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.476 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -90.98 63.65 5.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.836 0.351 . . . . 0.0 111.044 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.521 ' CA ' ' HA ' ' A' ' 66' ' ' CYS . . . 68.12 10.36 59.15 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.489 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 171.59 51.32 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.838 0.351 . . . . 0.0 110.945 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -111.88 -62.13 0.46 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.371 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.429 ' O ' ' HB ' ' A' ' 95' ' ' ILE . 0.4 OUTLIER -141.45 38.89 1.71 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.95 0.405 . . . . 0.0 110.827 179.808 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.455 HG21 ' OH ' ' A' ' 81' ' ' TYR . 2.7 mt -56.96 89.25 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.168 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.41 ' O ' ' HA ' ' A' ' 92' ' ' CYS . 27.0 t -84.71 138.72 32.48 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.791 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.474 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 0.5 OUTLIER -110.93 141.63 44.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.982 -179.931 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 1.5 t -156.89 121.55 4.48 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.054 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.948 HG23 ' O ' ' A' ' 89' ' ' ILE . 1.7 mp -66.48 138.84 22.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.086 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -64.65 106.2 1.13 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.167 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -105.61 111.68 24.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.876 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.252 -0.88 . . . . 0.0 110.971 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 22.7 t . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 120.836 0.351 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 3.1 mmtp -110.61 136.4 20.65 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.94 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -75.99 156.25 38.62 Favored 'Trans proline' 0 C--O 1.232 0.223 0 C-N-CA 122.832 2.355 . . . . 0.0 112.391 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 73.11 -154.44 49.53 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.873 -0.679 . . . . 0.0 112.455 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 85.0 m -138.99 135.16 34.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.837 0.351 . . . . 0.0 110.922 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 47.7 t80 -110.3 119.84 40.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.877 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -167.73 151.61 6.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.916 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.455 ' HB3' ' OH ' ' A' ' 28' ' ' TYR . 28.8 t-20 55.35 51.03 13.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.908 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 47.56 23.26 2.07 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.482 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.554 ' HB3' ' CE2' ' A' ' 28' ' ' TYR . 0.1 OUTLIER -132.29 139.12 48.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.842 0.353 . . . . 0.0 110.865 -179.977 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -109.23 85.9 2.19 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.947 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.554 ' CE2' ' HB3' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -79.84 165.15 23.0 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.815 179.948 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.523 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 0.0 OUTLIER -100.25 162.33 13.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.741 179.806 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.681 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.5 mp -49.53 156.23 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.351 -179.868 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.43 ' N ' HG22 ' A' ' 30' ' ' ILE . 1.7 m-80 56.86 19.65 4.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.066 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.523 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 10.1 tt0 -101.29 147.69 26.0 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.825 0.345 . . . . 0.0 110.91 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 14.2 mt-30 -116.75 145.46 43.47 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.016 -179.855 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' TRP . . . . . 0.6 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 42.0 p90 -150.35 168.88 22.79 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.785 179.862 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 76.2 tt0 -101.15 126.53 47.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.171 -179.741 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.471 ' HB2' ' SG ' ' A' ' 56' ' ' CYS . 1.5 mtp180 -119.4 176.95 5.1 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.674 179.847 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -144.61 132.46 21.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.701 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.524 ' HB2' HD22 ' A' ' 43' ' ' LEU . 0.6 OUTLIER -154.76 143.59 20.84 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.678 179.671 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.463 ' HB2' ' O ' ' A' ' 38' ' ' TYR . 3.4 mm? 66.76 22.51 10.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.484 -179.678 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 69.69 38.85 77.74 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.531 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -152.08 153.3 33.66 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-O 120.708 0.29 . . . . 0.0 110.984 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.88 ' O ' HD12 ' A' ' 43' ' ' LEU . . . -60.75 146.58 45.44 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.946 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.88 HD12 ' O ' ' A' ' 42' ' ' ALA . 4.3 mp -142.18 161.5 37.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.929 0.395 . . . . 0.0 111.364 -179.674 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.499 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.2 t -128.9 123.65 59.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.244 179.353 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.6 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 1.3 m -109.8 158.76 17.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.618 -179.263 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 24.7 m -146.38 119.53 8.86 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.797 179.644 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.544 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 28.7 t -74.16 143.69 45.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.158 -179.795 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.461 ' N ' ' O ' ' A' ' 53' ' ' GLY . 26.2 m-85 -119.4 -24.66 6.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.948 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 123.87 -169.07 15.98 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.453 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLY . . . . . 0.516 ' O ' ' CB ' ' A' ' 51' ' ' SER . . . -75.17 85.94 0.8 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.601 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.516 ' CB ' ' O ' ' A' ' 50' ' ' GLY . 0.3 OUTLIER 160.0 -62.91 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.823 0.344 . . . . 0.0 110.849 179.976 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -85.07 -29.94 24.49 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.024 -179.897 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLY . . . . . 0.461 ' O ' ' N ' ' A' ' 48' ' ' TYR . . . 70.34 -111.51 3.82 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.522 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.566 ' CE1' ' SG ' ' A' ' 45' ' ' CYS . 1.8 p90 -153.65 154.21 33.74 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.893 0.378 . . . . 0.0 110.886 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -133.2 93.96 3.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.622 179.777 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.499 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.4 OUTLIER -68.0 166.79 15.13 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.146 -179.673 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.491 ' HG2' ' N ' ' A' ' 58' ' ' SER . 14.6 tt0 -152.75 -89.69 0.05 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.131 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.491 ' N ' ' HG2' ' A' ' 57' ' ' GLU . 0.1 OUTLIER -164.49 -167.18 1.22 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.976 179.953 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.45 ' O ' ' O ' ' A' ' 60' ' ' PRO . 0.0 OUTLIER -164.47 110.78 0.88 Allowed Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.972 -179.948 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.45 ' O ' ' O ' ' A' ' 59' ' ' LYS . 63.8 Cg_exo -51.46 -163.1 0.0 OUTLIER 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.703 2.269 . . . . 0.0 112.342 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -121.3 -66.16 1.07 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.894 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -125.33 163.76 21.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.113 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.649 ' O ' ' HB2' ' A' ' 97' ' ' ALA . 2.8 tt0 -95.19 -18.63 20.74 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.452 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -66.57 -169.02 0.07 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.826 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 7.2 p 48.01 -177.56 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.18 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.42 ' SG ' ' HB2' ' A' ' 75' ' ' TYR . 18.5 p -150.12 -156.33 0.71 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.791 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.465 ' O ' ' N ' ' A' ' 69' ' ' LYS . 12.6 t80 -168.32 81.77 0.17 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.891 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -52.74 87.08 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.872 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.465 ' N ' ' O ' ' A' ' 67' ' ' PHE . 2.0 pttt -52.67 -29.84 28.68 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.862 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.403 ' C ' ' O ' ' A' ' 69' ' ' LYS . 8.3 m-30 -38.4 -56.49 1.24 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.903 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -122.58 -8.08 8.55 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.09 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 80.12 69.67 1.38 Allowed Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.511 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 12.8 m120 -122.37 -162.88 1.03 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.942 0.401 . . . . 0.0 110.965 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 18.0 m -144.39 105.21 4.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.976 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.42 ' HB2' ' SG ' ' A' ' 66' ' ' CYS . 19.3 m-85 -120.68 160.38 23.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.747 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -91.58 146.56 23.69 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.797 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 93.7 t -45.59 -37.74 2.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.096 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -95.39 14.8 64.46 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.515 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -107.52 100.69 10.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.922 0.391 . . . . 0.0 110.996 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.876 HG22 HG23 ' A' ' 93' ' ' THR . 64.6 p -73.98 143.6 45.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.205 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.743 ' OH ' HG21 ' A' ' 102' ' ' ILE . 42.2 p90 -133.88 109.98 9.42 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.784 179.842 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -50.4 168.24 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.083 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -167.66 86.58 0.75 Allowed Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.801 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo -69.13 91.94 0.45 Allowed 'Trans proline' 0 C--O 1.232 0.195 0 C-N-CA 122.734 2.289 . . . . 0.0 112.402 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 2.8 mttt -128.26 132.54 48.72 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.788 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 4.8 t0 74.95 10.23 3.85 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.884 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 66.3 30.4 9.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.852 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.433 ' HG3' HG12 ' A' ' 106' ' ' ILE . 2.3 tpt -120.45 -29.91 4.67 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.919 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.448 ' C ' ' CD1' ' A' ' 90' ' ' TRP . 84.4 mt 58.77 129.02 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.057 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' TRP . . . . . 0.758 ' CH2' HD11 ' A' ' 106' ' ' ILE . 0.7 OUTLIER -136.15 132.49 36.07 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.852 -179.992 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.468 ' N ' ' O ' ' A' ' 105' ' ' THR . 0.5 OUTLIER -70.77 62.22 0.27 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.865 -179.972 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 64.2 m -51.48 136.74 25.39 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.998 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.876 HG23 HG22 ' A' ' 80' ' ' THR . 0.2 OUTLIER -126.84 124.83 40.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.912 179.872 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.52 ' HA ' HG23 ' A' ' 102' ' ' ILE . 0.5 OUTLIER -60.37 73.14 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.938 -179.897 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.517 ' N ' ' O ' ' A' ' 93' ' ' THR . 1.9 mt -88.89 58.81 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.238 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 174.24 161.85 24.91 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.481 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.649 ' HB2' ' O ' ' A' ' 63' ' ' GLU . . . -107.71 53.32 0.69 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.817 0.341 . . . . 0.0 110.961 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 95.75 -3.39 65.21 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.523 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.446 ' CG ' ' O ' ' A' ' 99' ' ' ARG . 1.9 ttm180 -173.23 40.83 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.859 0.361 . . . . 0.0 110.94 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 0.445 ' O ' ' HB3' ' A' ' 101' ' ' ARG . . . -94.82 -79.85 1.47 Allowed Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.43 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.445 ' HB3' ' O ' ' A' ' 100' ' ' GLY . 0.0 OUTLIER 171.33 51.33 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.758 0.313 . . . . 0.0 110.9 179.992 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.743 HG21 ' OH ' ' A' ' 81' ' ' TYR . 3.5 mm -37.11 97.88 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.143 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.402 ' N ' ' O ' ' A' ' 101' ' ' ARG . 3.4 t -71.92 157.49 37.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.948 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 89.5 m -150.03 114.37 5.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.924 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' THR . . . . . 0.468 ' O ' ' N ' ' A' ' 91' ' ' ASP . 8.8 t -129.63 154.27 47.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.19 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.758 HD11 ' CH2' ' A' ' 90' ' ' TRP . 2.9 mt -87.72 125.23 41.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.019 179.828 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -173.53 117.69 0.27 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.124 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -128.89 165.84 20.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.926 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 12.1 ttp180 . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.204 -0.903 . . . . 0.0 110.927 179.928 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 120.857 0.36 . . . . 0.0 111.188 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 3.4 mtmp? -153.16 127.71 4.65 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.919 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.468 ' HB2' HD11 ' A' ' 30' ' ' ILE . 73.9 Cg_endo -76.3 138.53 20.09 Favored 'Trans proline' 0 N--CA 1.463 -0.318 0 C-N-CA 122.799 2.333 . . . . 0.0 112.4 -179.911 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 114.37 162.91 14.41 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.499 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 86.9 m -116.54 115.26 25.43 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.808 0.337 . . . . 0.0 110.863 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -91.26 114.35 26.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.951 -179.955 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -154.59 156.05 35.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.963 -179.906 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 46.1 t30 52.36 27.11 4.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.955 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 76.07 1.02 67.05 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.545 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 2.5 mptt -110.96 148.59 32.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.831 0.348 . . . . 0.0 110.939 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 4.5 t-160 -117.15 88.81 2.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.863 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -79.64 -175.19 4.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.96 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.506 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 10.6 tt0 -105.92 156.55 18.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.895 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.687 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.3 mp -52.8 156.59 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.34 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.422 ' N ' HG22 ' A' ' 30' ' ' ILE . 0.7 OUTLIER 59.42 14.22 3.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.981 179.866 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.506 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 21.1 tt0 -96.06 155.09 16.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.933 179.938 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 40.4 mt-30 -122.87 134.65 54.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.981 -179.884 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' TRP . . . . . 0.586 ' CZ2' ' HB3' ' A' ' 45' ' ' CYS . 23.4 p90 -136.01 175.07 9.93 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.964 179.827 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -100.37 127.6 46.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.036 -179.906 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.522 ' O ' ' CB ' ' A' ' 43' ' ' LEU . 17.5 tpt85 -128.31 162.75 26.33 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.643 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -140.54 129.96 23.93 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.562 -179.813 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.467 ' CD1' ' HB2' ' A' ' 39' ' ' LEU . 12.3 t80 -127.73 119.25 25.38 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.914 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.467 ' HB2' ' CD1' ' A' ' 38' ' ' TYR . 3.4 tp 76.26 13.29 2.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.722 -179.824 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 84.66 39.45 8.83 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.7 180.0 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.42 ' O ' ' C ' ' A' ' 42' ' ' ALA . 7.5 m-80 -141.67 125.52 17.06 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.734 0.302 . . . . 0.0 110.846 179.866 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.503 ' O ' HD12 ' A' ' 43' ' ' LEU . . . -35.55 147.77 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.946 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.522 ' CB ' ' O ' ' A' ' 36' ' ' ARG . 1.1 tp -159.28 150.7 20.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.224 -179.608 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.485 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 3.1 t -122.37 135.48 62.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.358 179.541 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.586 ' HB3' ' CZ2' ' A' ' 34' ' ' TRP . 0.7 OUTLIER -118.69 157.13 28.05 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.396 -179.429 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.434 ' O ' ' CE1' ' A' ' 48' ' ' TYR . 76.1 m -140.44 116.17 10.24 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.97 179.799 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.544 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 19.4 t -75.59 132.38 40.61 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.979 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.434 ' CE1' ' O ' ' A' ' 46' ' ' THR . 7.3 m-85 -105.52 -26.04 12.06 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.749 179.883 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.446 ' N ' HG23 ' A' ' 30' ' ' ILE . . . 87.02 163.24 38.63 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.551 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 58.79 -129.99 50.4 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.529 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -96.48 -13.06 23.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.848 0.356 . . . . 0.0 110.849 -179.918 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.409 ' HB3' ' CB ' ' A' ' 48' ' ' TYR . 0.4 OUTLIER -50.41 -33.49 20.95 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.96 -179.941 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 63.72 161.02 0.35 Allowed Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.785 -0.722 . . . . 0.0 112.537 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.574 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 4.0 p90 -91.45 161.36 15.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.859 0.361 . . . . 0.0 110.851 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -139.9 120.69 14.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.871 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.485 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.8 OUTLIER -90.95 168.2 11.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.938 -179.911 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -176.23 -178.23 0.96 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.978 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.474 ' O ' ' HD3' ' A' ' 60' ' ' PRO . 17.3 m -80.09 160.01 25.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.91 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.429 ' O ' ' OE1' ' A' ' 61' ' ' GLU . 3.1 mttt -81.62 110.62 20.28 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.804 179.915 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.474 ' HD3' ' O ' ' A' ' 58' ' ' SER . 53.7 Cg_exo -51.6 96.72 0.04 OUTLIER 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.66 2.24 . . . . 0.0 112.288 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.429 ' OE1' ' O ' ' A' ' 59' ' ' LYS . 0.5 OUTLIER -112.73 24.65 12.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.988 179.909 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -129.59 127.97 41.75 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.144 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.97 118.35 8.96 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.129 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.412 ' O ' ' O ' ' A' ' 65' ' ' THR . 0.1 OUTLIER -68.05 -166.89 0.07 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.911 179.959 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.412 ' O ' ' O ' ' A' ' 64' ' ' GLU . 6.2 p 46.45 -175.34 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.014 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.488 ' O ' HG23 ' A' ' 74' ' ' THR . 0.5 OUTLIER -160.91 -175.17 4.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.108 -179.877 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -130.08 143.54 50.85 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.836 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ASP . . . . . 0.511 ' O ' ' N ' ' A' ' 72' ' ' GLY . 0.5 OUTLIER -117.3 81.75 1.7 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.914 -179.925 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 28.2 pttt -44.64 -33.54 1.85 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.834 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 4.1 m-30 -44.44 -61.3 1.58 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.809 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -134.03 27.31 3.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.978 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' GLY . . . . . 0.511 ' N ' ' O ' ' A' ' 68' ' ' ASP . . . 46.51 81.86 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.484 179.926 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ASN . . . . . 0.568 ' HB3' ' CZ ' ' A' ' 75' ' ' TYR . 2.5 m120 -148.18 111.86 5.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.824 0.345 . . . . 0.0 110.961 -179.922 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.488 HG23 ' O ' ' A' ' 66' ' ' CYS . 18.7 m -80.21 125.97 30.52 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.954 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.568 ' CZ ' ' HB3' ' A' ' 73' ' ' ASN . 78.2 m-85 -121.26 175.78 5.96 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.634 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ARG . . . . . 0.427 ' HB2' ' HB2' ' A' ' 79' ' ' ASP . 22.1 mtm180 -92.1 154.63 18.6 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.887 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.403 HG22 ' HA ' ' A' ' 97' ' ' ALA . 89.9 t -57.35 -63.32 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.127 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -83.4 51.59 4.6 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.474 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 0.427 ' HB2' ' HB2' ' A' ' 76' ' ' ARG . 10.7 t0 -147.55 125.11 11.72 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.779 0.323 . . . . 0.0 110.92 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 44.6 p -86.23 150.24 24.52 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.068 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.485 ' OH ' HG21 ' A' ' 102' ' ' ILE . 47.2 p90 -148.97 114.54 5.61 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.977 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.483 ' HG3' ' OD1' ' A' ' 91' ' ' ASP . 18.6 mt-10 -65.77 141.56 58.27 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.845 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.21 86.37 31.06 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.798 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 77.7 Cg_exo -49.93 96.8 0.03 OUTLIER 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.723 2.282 . . . . 0.0 112.354 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -121.33 136.5 54.96 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.984 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 53.2 -155.37 0.2 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.946 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 7.7 t -89.2 43.96 1.18 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.996 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.555 ' O ' ' CD1' ' A' ' 90' ' ' TRP . 2.9 ttm -175.67 126.16 0.23 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.952 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 9.1 mt -87.03 128.71 39.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.037 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' TRP . . . . . 0.575 ' CZ3' HD11 ' A' ' 106' ' ' ILE . 1.2 m95 -119.92 120.45 36.42 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.912 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.483 ' OD1' ' HG3' ' A' ' 82' ' ' GLU . 0.2 OUTLIER -60.58 87.85 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.844 179.94 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 25.4 m -67.77 123.36 20.3 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.985 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.41 ' O ' ' HA ' ' A' ' 102' ' ' ILE . 82.5 m -112.23 136.45 51.63 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.914 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 44.2 t -70.08 62.58 0.21 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.053 -179.727 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.488 ' HB ' ' O ' ' A' ' 101' ' ' ARG . 2.7 mt -71.4 96.48 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.087 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.52 ' O ' ' N ' ' A' ' 98' ' ' GLY . . . 123.85 103.98 1.61 Allowed Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.363 -179.924 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.403 ' HA ' HG22 ' A' ' 77' ' ' VAL . . . -49.29 85.28 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.795 0.331 . . . . 0.0 111.356 -179.741 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.52 ' N ' ' O ' ' A' ' 96' ' ' GLY . . . 119.24 10.98 7.7 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.603 -0.808 . . . . 0.0 113.004 179.693 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.498 ' HB3' ' O ' ' A' ' 98' ' ' GLY . 0.1 OUTLIER 83.29 107.91 0.06 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.922 0.392 . . . . 0.0 110.838 -179.982 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 0.471 ' O ' ' HG3' ' A' ' 101' ' ' ARG . . . -150.11 -38.46 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.393 179.86 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.488 ' O ' ' HB ' ' A' ' 95' ' ' ILE . 0.7 OUTLIER -146.02 38.58 1.09 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.71 0.291 . . . . 0.0 111.041 179.913 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.485 HG21 ' OH ' ' A' ' 81' ' ' TYR . 17.6 mt -47.59 90.69 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.18 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.462 ' N ' ' O ' ' A' ' 101' ' ' ARG . 0.2 OUTLIER -87.24 149.33 24.66 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.916 179.926 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 3.6 m -134.6 109.22 8.51 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.921 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -106.27 143.2 34.74 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.088 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.575 HD11 ' CZ3' ' A' ' 90' ' ' TRP . 2.5 mp -66.48 94.34 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.117 179.938 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -128.32 113.13 15.23 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.152 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' ASN . . . . . 0.405 ' O ' ' HB3' ' A' ' 109' ' ' ARG . 21.9 t-20 -175.4 68.16 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.958 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 109' ' ' ARG . . . . . 0.405 ' HB3' ' O ' ' A' ' 108' ' ' ASN . 4.6 ptp180 . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.899 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 120.827 0.346 . . . . 0.0 111.189 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -38.26 97.51 0.14 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.906 179.929 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -54.82 143.39 71.21 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.643 2.229 . . . . 0.0 112.274 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 142.21 -171.88 24.43 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.55 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -159.99 110.42 1.88 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.817 0.341 . . . . 0.0 110.92 -179.94 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -90.05 140.49 29.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.916 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.451 ' OD1' ' O ' ' A' ' 26' ' ' LYS . 1.1 p-10 -126.98 -160.95 1.03 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.848 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.432 ' C ' ' O ' ' A' ' 23' ' ' ASP . 0.7 OUTLIER -34.87 -52.25 0.53 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.009 -0.542 . . . . 0.0 111.068 -179.882 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -163.5 22.81 0.18 Allowed Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.62 180.0 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.53 ' CE ' ' HA ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -128.95 144.82 51.3 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.798 0.332 . . . . 0.0 110.969 179.797 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 4.2 t-160 -119.66 85.42 2.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.302 -179.708 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.526 ' CE2' ' CG ' ' A' ' 34' ' ' TRP . 96.6 m-85 -85.01 166.3 16.83 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.833 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.514 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 0.0 OUTLIER -91.86 149.4 21.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.608 179.705 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.66 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.8 mp -41.58 147.14 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 120.851 0.357 . . . . 0.0 111.191 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.476 ' HB2' ' O ' ' A' ' 30' ' ' ILE . 70.4 m-20 67.17 11.47 8.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.301 179.813 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.514 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 10.2 tp60 -99.24 145.06 27.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.799 0.333 . . . . 0.0 110.613 179.66 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -112.63 156.51 22.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.173 -179.714 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' TRP . . . . . 0.571 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 48.9 p90 -160.87 173.99 14.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.887 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.455 ' HG3' ' O ' ' A' ' 43' ' ' LEU . 0.1 OUTLIER -99.92 141.78 32.29 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.113 -179.823 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.52 ' O ' ' N ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -140.36 169.81 16.98 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.724 179.886 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -137.45 125.76 23.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.769 -179.762 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.42 ' HB2' HD22 ' A' ' 43' ' ' LEU . 6.1 t80 -119.6 136.84 54.2 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.681 179.718 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.516 ' HA ' HD12 ' A' ' 39' ' ' LEU . 2.4 tp 64.24 13.1 7.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.693 -179.77 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 85.71 29.65 26.03 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.933 -0.651 . . . . 0.0 112.743 179.847 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -133.39 145.67 50.54 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.784 0.326 . . . . 0.0 111.027 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -43.75 151.29 0.21 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.64 179.768 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.52 ' N ' ' O ' ' A' ' 36' ' ' ARG . 4.4 tp -170.24 165.59 8.96 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.951 0.405 . . . . 0.0 111.379 -179.615 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.494 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 17.7 t -132.31 151.97 35.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.398 179.459 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.571 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 0.5 OUTLIER -129.26 153.56 47.67 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.903 0.382 . . . . 0.0 111.423 -179.564 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 69.4 m -138.4 131.96 30.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.757 179.715 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.498 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 21.0 t -92.86 161.5 14.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.042 -179.728 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.516 ' O ' ' CG2' ' A' ' 30' ' ' ILE . 36.8 m-85 -138.62 -43.99 0.49 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.771 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 104.2 167.67 24.89 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.469 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 65.95 -113.38 5.7 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.613 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -104.29 -24.65 13.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.783 0.325 . . . . 0.0 110.992 -179.875 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.483 ' HB3' ' HB2' ' A' ' 48' ' ' TYR . 0.1 OUTLIER -54.99 -36.33 65.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.847 -179.952 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 63.48 -103.89 0.75 Allowed Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.549 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.552 ' CE1' ' SG ' ' A' ' 45' ' ' CYS . 1.4 p90 -158.58 166.69 31.51 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.854 0.359 . . . . 0.0 111.002 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -149.07 112.23 4.92 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.658 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.494 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.6 OUTLIER -83.4 170.93 13.99 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.121 -179.752 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 171.99 178.78 0.07 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.965 -179.879 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.3 p -59.36 173.42 0.51 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.018 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.88 84.34 38.28 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.045 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_exo -55.89 98.33 0.06 OUTLIER 'Trans proline' 0 C--O 1.231 0.152 0 C-N-CA 122.846 2.364 . . . . 0.0 112.338 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.523 ' CG ' ' O ' ' A' ' 61' ' ' GLU . 8.1 tt0 -117.41 65.69 0.73 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.902 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.438 ' O ' ' O ' ' A' ' 61' ' ' GLU . . . 42.13 -169.15 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.111 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -100.83 -28.04 13.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.575 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.5 ' HG2' ' HG2' ' A' ' 76' ' ' ARG . 0.0 OUTLIER -92.01 117.18 29.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.894 -179.919 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -171.23 163.94 7.18 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.239 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 175.86 171.65 0.36 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.876 -180.0 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -179.28 94.0 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.963 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ASP . . . . . 0.583 ' HB2' ' CE2' ' A' ' 75' ' ' TYR . 38.7 t0 -69.02 81.65 0.31 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.731 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 7.3 pttm -41.75 -31.31 0.29 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.907 -179.905 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 8.0 m-30 -51.64 -27.36 11.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.759 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 24.0 p -137.7 -54.47 0.67 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.087 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 126.98 4.06 6.14 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.56 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ASN . . . . . 0.528 ' HB3' ' CE1' ' A' ' 75' ' ' TYR . 2.2 m120 -70.95 149.29 46.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.835 0.35 . . . . 0.0 110.943 -179.937 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 91.7 m -103.54 117.11 33.69 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.992 179.839 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.583 ' CE2' ' HB2' ' A' ' 68' ' ' ASP . 6.5 m-85 -105.79 -160.51 0.75 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.806 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ARG . . . . . 0.5 ' HG2' ' HG2' ' A' ' 64' ' ' GLU . 0.0 OUTLIER -142.05 133.35 26.4 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.721 179.839 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 55.0 t -49.97 -26.21 2.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.166 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -89.12 21.79 26.07 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.418 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -145.95 135.05 22.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.801 0.334 . . . . 0.0 111.083 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 3.2 p -107.2 171.92 7.11 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.176 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 49.0 p90 -165.28 150.11 9.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.869 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -87.47 133.31 33.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.08 -179.848 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 20.3 ttp180 -132.95 73.02 76.21 Favored Pre-proline 0 C--N 1.327 -0.385 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.708 179.712 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_exo -46.5 152.34 1.54 Allowed 'Trans proline' 0 C--N 1.342 0.219 0 C-N-CA 122.797 2.332 . . . . 0.0 112.589 -179.862 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 5.7 tptp -178.77 160.34 1.15 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.822 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 54.03 35.6 22.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.921 -179.918 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.9 m 60.8 48.17 7.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.868 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -169.68 160.51 8.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.823 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 2.5 mp -100.12 133.66 42.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.983 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' TRP . . . . . 0.524 ' CD1' ' N ' ' A' ' 90' ' ' TRP . 1.4 m95 -134.77 112.78 11.02 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.93 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -68.36 80.99 0.25 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.917 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' CYS . . . . . 0.435 ' HA ' ' HA ' ' A' ' 104' ' ' CYS . 0.6 OUTLIER -54.85 178.79 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.896 179.938 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 97.5 m -157.23 131.2 8.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.095 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 9.2 t -72.25 74.71 0.98 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 -179.881 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.819 HG22 ' CA ' ' A' ' 100' ' ' GLY . 1.0 OUTLIER -78.77 115.64 21.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.369 -179.94 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -149.45 97.5 0.18 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.512 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -159.59 61.26 0.38 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.859 0.361 . . . . 0.0 110.994 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.489 ' O ' ' CB ' ' A' ' 99' ' ' ARG . . . 72.28 8.94 71.66 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.54 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.489 ' CB ' ' O ' ' A' ' 98' ' ' GLY . 0.0 OUTLIER 161.24 45.56 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.904 0.383 . . . . 0.0 111.012 -179.985 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 0.819 ' CA ' HG22 ' A' ' 95' ' ' ILE . . . -89.58 -52.61 2.62 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.386 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.484 ' CD ' ' O ' ' A' ' 100' ' ' GLY . 0.0 OUTLIER 48.56 105.7 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.816 0.341 . . . . 0.0 111.107 179.926 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.42 ' C ' ' O ' ' A' ' 101' ' ' ARG . 3.6 mp -36.92 130.82 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.922 179.755 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.41 ' O ' ' HA ' ' A' ' 92' ' ' CYS . 13.2 t -127.66 159.96 33.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.047 -179.785 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.435 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 0.5 OUTLIER -134.15 127.45 32.07 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.801 179.94 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 105' ' ' THR . . . . . 0.542 ' O ' HG23 ' A' ' 105' ' ' THR . 4.8 t -148.15 121.15 8.81 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.271 -179.86 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.464 HD11 ' CH2' ' A' ' 90' ' ' TRP . 2.7 mt -44.15 151.06 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.056 179.902 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -88.15 122.81 32.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.14 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -60.4 145.8 46.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.969 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 2.9 ttp180 . . . . . 0 C--O 1.25 1.088 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.893 179.984 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 6.4 t . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 120.898 0.38 . . . . 0.0 111.165 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 176.35 141.04 0.22 Allowed Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.894 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -68.38 -163.23 0.09 OUTLIER 'Trans proline' 0 N--CA 1.465 -0.172 0 C-N-CA 122.654 2.236 . . . . 0.0 112.12 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.463 ' CA ' HD11 ' A' ' 30' ' ' ILE . . . 101.45 137.62 9.81 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.474 -179.911 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 2.0 m -84.23 151.25 24.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.781 0.324 . . . . 0.0 110.854 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 82.7 t80 -157.61 109.95 2.39 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.907 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.462 ' OD1' ' N ' ' A' ' 24' ' ' ASN . 38.8 t0 -151.48 157.85 42.86 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.923 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.462 ' N ' ' OD1' ' A' ' 23' ' ' ASP . 30.1 t30 56.54 26.43 11.0 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.932 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 76.17 7.35 84.49 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.465 179.875 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.439 ' HB3' ' CE2' ' A' ' 28' ' ' TYR . 0.1 OUTLIER -116.02 141.38 48.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.856 0.36 . . . . 0.0 110.897 179.946 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 5.2 t-80 -113.58 89.29 3.05 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.041 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.439 ' CE2' ' HB3' ' A' ' 26' ' ' LYS . 94.8 m-85 -87.17 145.19 26.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.806 179.899 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.511 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 10.4 tt0 -62.97 151.68 38.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.091 179.629 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.528 HD12 ' HA2' ' A' ' 49' ' ' GLY . 19.8 mm -50.56 144.28 2.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.935 0.397 . . . . 0.0 110.827 -179.779 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.475 ' HB2' ' O ' ' A' ' 30' ' ' ILE . 5.4 m-20 71.23 3.74 4.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.121 -179.808 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.511 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 29.7 tp60 -80.01 151.14 30.14 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.709 179.582 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.41 ' CG ' HG23 ' A' ' 46' ' ' THR . 25.2 mt-30 -115.37 142.78 46.23 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.783 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' TRP . . . . . 0.425 ' CZ3' ' HB2' ' A' ' 47' ' ' CYS . 40.6 p90 -145.45 171.3 14.84 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.943 0.401 . . . . 0.0 111.072 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 13.8 tm-20 -100.66 140.28 35.16 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.227 -179.763 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -137.18 -167.89 2.19 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.362 179.714 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.559 ' CG2' ' N ' ' A' ' 38' ' ' TYR . 1.8 t -151.2 -51.77 0.13 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.679 0.276 . . . . 0.0 111.55 179.791 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.559 ' N ' ' CG2' ' A' ' 37' ' ' THR . 18.4 t80 44.86 104.97 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.267 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.486 ' CB ' ' O ' ' A' ' 38' ' ' TYR . 1.7 tp 82.77 15.56 0.37 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.779 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 66.13 51.68 42.65 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.81 -0.709 . . . . 0.0 112.717 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.473 ' O ' ' HA ' ' A' ' 37' ' ' THR . 62.2 m-80 -150.95 129.28 12.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.609 0.242 . . . . 0.0 110.983 179.866 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.434 ' O ' ' HA ' ' A' ' 58' ' ' SER . . . -32.96 119.43 0.32 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.032 179.964 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.698 HD12 ' C ' ' A' ' 57' ' ' GLU . 15.0 tp -145.13 146.19 31.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.208 -179.529 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.488 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 4.1 t -130.62 139.07 52.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.551 179.659 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.517 ' SG ' ' CD1' ' A' ' 54' ' ' PHE . 0.4 OUTLIER -123.84 150.45 44.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.291 -179.626 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.545 ' O ' ' CE1' ' A' ' 48' ' ' TYR . 24.1 m -134.74 118.64 17.31 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.85 179.803 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.469 ' SG ' ' HA ' ' A' ' 30' ' ' ILE . 38.1 t -71.01 152.96 43.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.977 0.418 . . . . 0.0 110.932 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.545 ' CE1' ' O ' ' A' ' 46' ' ' THR . 5.3 m-85 -125.78 -31.26 2.94 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.133 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.528 ' HA2' HD12 ' A' ' 30' ' ' ILE . . . 89.55 179.01 45.14 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.5 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 52.73 -113.63 2.91 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.469 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 5.9 m -111.33 -23.74 10.62 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.818 0.342 . . . . 0.0 110.939 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.499 ' HB2' ' HB2' ' A' ' 48' ' ' TYR . 55.8 mtm180 -50.76 -39.42 52.3 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.873 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' GLY . . . . . 0.445 ' O ' ' N ' ' A' ' 48' ' ' TYR . . . 70.53 -131.84 22.16 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.665 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.517 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 3.6 p90 -146.97 162.65 38.31 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.876 0.369 . . . . 0.0 110.961 -179.873 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.471 ' HB3' ' OH ' ' A' ' 48' ' ' TYR . 9.7 t-20 -143.06 126.43 16.67 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.696 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.503 ' HB3' HD21 ' A' ' 43' ' ' LEU . 2.0 m -87.19 166.66 14.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.101 -179.864 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.698 ' C ' HD12 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -171.32 135.58 0.96 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.901 -179.934 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.532 ' N ' HD12 ' A' ' 43' ' ' LEU . 0.1 OUTLIER -50.01 140.17 12.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.053 -179.99 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -48.4 131.53 13.26 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.783 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.468 ' O ' ' HB3' ' A' ' 61' ' ' GLU . 34.9 Cg_endo -65.26 178.46 2.01 Favored 'Trans proline' 0 C--O 1.232 0.175 0 C-N-CA 122.706 2.271 . . . . 0.0 112.284 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.493 ' CG ' ' O ' ' A' ' 61' ' ' GLU . 5.3 tm-20 66.49 12.68 8.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.857 -179.875 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.465 ' O ' ' O ' ' A' ' 61' ' ' GLU . . . 51.29 169.21 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.153 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -119.94 125.35 48.23 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.614 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.451 ' O ' ' O ' ' A' ' 65' ' ' THR . 0.0 OUTLIER -176.97 161.34 1.93 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.033 -179.969 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.472 ' O ' ' HA ' ' A' ' 97' ' ' ALA . 2.8 p 46.14 -177.84 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.308 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 24.7 p -175.14 162.7 3.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.788 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.504 ' CB ' ' HA2' ' A' ' 98' ' ' GLY . 82.3 t80 -117.97 126.24 51.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.042 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -82.05 105.22 12.97 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.748 179.83 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.64 -1.21 17.96 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.162 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 3.8 m-30 -94.32 -25.13 17.13 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.843 0.354 . . . . 0.0 110.862 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 1.1 p -142.45 -47.96 0.34 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.226 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 113.75 39.99 1.04 Allowed Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.454 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ASN . . . . . 0.492 ' HB3' ' CZ ' ' A' ' 75' ' ' TYR . 0.8 OUTLIER -113.1 120.28 40.76 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.803 0.335 . . . . 0.0 110.788 -179.968 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 41.7 m -69.28 128.51 36.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.013 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.492 ' CZ ' ' HB3' ' A' ' 73' ' ' ASN . 62.1 m-85 -130.97 -171.6 2.61 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.788 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 23.0 mtp85 -103.49 134.8 46.24 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.736 179.875 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 9.0 p -57.46 -22.98 18.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.138 -179.909 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -92.52 23.48 27.73 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.486 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -142.64 128.19 19.07 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.882 0.372 . . . . 0.0 110.886 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.491 ' OG1' ' N ' ' A' ' 81' ' ' TYR . 0.1 OUTLIER -101.29 176.1 5.36 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.061 179.993 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.811 ' OH ' HG21 ' A' ' 102' ' ' ILE . 33.8 p90 -154.41 138.25 16.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.861 -179.873 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.406 ' HA ' ' HA ' ' A' ' 91' ' ' ASP . 4.4 mt-10 -69.96 136.57 50.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.006 0.432 . . . . 0.0 110.857 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.442 ' HD3' ' HA ' ' A' ' 83' ' ' ARG . 0.0 OUTLIER -154.14 93.83 2.9 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.83 -179.935 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -66.82 166.74 21.5 Favored 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.737 2.292 . . . . 0.0 112.282 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 178.45 158.73 0.51 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.888 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 38.7 t0 59.28 -89.71 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.861 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 10.4 p -156.34 25.37 0.35 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.942 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.448 ' O ' ' CD1' ' A' ' 90' ' ' TRP . 0.0 OUTLIER -154.15 152.61 30.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.985 -179.926 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 7.9 mt -92.07 130.6 40.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.054 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' TRP . . . . . 0.573 ' CE3' HG13 ' A' ' 106' ' ' ILE . 0.8 OUTLIER -128.38 129.93 46.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.883 -179.944 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.406 ' HA ' ' HA ' ' A' ' 82' ' ' GLU . 0.7 OUTLIER -83.49 69.91 10.14 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.923 179.925 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 92' ' ' CYS . . . . . 0.461 ' HA ' ' O ' ' A' ' 103' ' ' SER . 0.8 OUTLIER -44.2 127.19 5.49 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.03 -179.954 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.507 ' O ' ' N ' ' A' ' 95' ' ' ILE . 6.0 m -105.59 120.64 42.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.985 179.815 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.835 ' HA ' HG23 ' A' ' 102' ' ' ILE . 0.1 OUTLIER -58.38 77.63 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.949 -179.859 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.507 ' N ' ' O ' ' A' ' 93' ' ' THR . 1.8 mt -89.87 131.59 36.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.259 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 115.38 -142.29 17.51 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.539 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.472 ' HA ' ' O ' ' A' ' 65' ' ' THR . . . -163.27 43.76 0.11 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.864 0.364 . . . . 0.0 110.939 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.504 ' HA2' ' CB ' ' A' ' 67' ' ' PHE . . . 93.43 12.6 57.0 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.537 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -167.77 38.05 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.818 0.342 . . . . 0.0 111.01 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 0.408 ' O ' ' HB3' ' A' ' 101' ' ' ARG . . . -118.96 -91.67 1.4 Allowed Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.491 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.408 ' HB3' ' O ' ' A' ' 100' ' ' GLY . 0.0 OUTLIER 168.49 109.67 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.867 0.365 . . . . 0.0 110.875 -179.969 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.835 HG23 ' HA ' ' A' ' 94' ' ' CYS . 1.2 mm -69.69 74.64 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.153 -179.971 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.461 ' O ' ' HA ' ' A' ' 92' ' ' CYS . 13.4 t -41.99 156.56 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.893 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.47 ' SG ' ' HB2' ' A' ' 90' ' ' TRP . 0.0 OUTLIER -138.7 97.25 3.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.902 -179.943 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 4.5 t -103.88 135.57 45.16 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.158 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.573 HG13 ' CE3' ' A' ' 90' ' ' TRP . 2.5 mp -48.99 145.07 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.011 179.935 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -71.35 98.43 1.77 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.086 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -137.2 136.37 38.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.909 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 5.5 mtt-85 . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.18 -0.914 . . . . 0.0 110.889 179.91 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.375 0 CA-C-O 120.758 0.313 . . . . 0.0 111.181 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 8.9 mttt -116.88 144.94 34.42 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.975 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -69.95 152.2 68.23 Favored 'Trans proline' 0 N--CA 1.464 -0.209 0 C-N-CA 122.718 2.279 . . . . 0.0 112.271 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.57 ' N ' HD11 ' A' ' 30' ' ' ILE . . . 106.77 -164.05 13.36 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.538 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -155.45 155.49 33.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.794 0.33 . . . . 0.0 110.845 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -142.65 130.59 21.75 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.817 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.41 ' O ' ' N ' ' A' ' 26' ' ' LYS . 1.4 t0 -161.73 144.25 11.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.136 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 44.81 28.79 0.38 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.232 179.782 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 85.25 -10.34 63.99 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.762 179.747 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.41 ' N ' ' O ' ' A' ' 23' ' ' ASP . 0.9 OUTLIER -89.85 140.37 29.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.872 0.367 . . . . 0.0 110.787 179.979 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 33.1 t60 -120.1 92.34 3.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.257 -179.757 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.434 ' CE2' ' CD1' ' A' ' 34' ' ' TRP . 0.1 OUTLIER -83.43 165.24 19.38 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.765 179.713 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.526 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 8.7 tt0 -94.9 145.19 25.08 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.837 179.987 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.702 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.7 mp -48.91 150.81 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.349 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 78.8 m-20 59.84 17.24 6.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.125 179.74 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.526 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 1.1 tt0 -102.88 154.35 19.29 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.838 0.351 . . . . 0.0 110.934 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -120.32 138.71 53.55 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.901 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' TRP . . . . . 0.555 ' CZ3' ' HB2' ' A' ' 47' ' ' CYS . 31.3 p90 -146.36 -176.93 5.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.871 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -108.79 123.46 49.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.024 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.518 ' O ' ' CB ' ' A' ' 43' ' ' LEU . 0.5 OUTLIER -131.75 167.6 19.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.603 179.766 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.477 ' HG1' ' C ' ' A' ' 41' ' ' ASN . 1.6 t -134.23 137.11 44.11 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.919 179.836 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.488 ' O ' ' CB ' ' A' ' 39' ' ' LEU . 22.1 t80 -107.74 108.54 19.81 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.874 -179.837 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.488 ' CB ' ' O ' ' A' ' 38' ' ' TYR . 6.7 tp 82.36 -49.24 0.19 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.821 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 165.16 36.94 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.795 -0.716 . . . . 0.0 112.51 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.477 ' C ' ' HG1' ' A' ' 37' ' ' THR . 68.9 m-80 -141.08 128.78 21.55 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 120.735 0.303 . . . . 0.0 111.053 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.478 ' O ' ' CD1' ' A' ' 43' ' ' LEU . . . -36.16 150.94 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.908 179.856 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.518 ' CB ' ' O ' ' A' ' 36' ' ' ARG . 1.4 tp -167.64 153.6 7.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.906 0.384 . . . . 0.0 111.275 -179.734 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.505 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.3 t -119.81 123.03 70.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.192 179.35 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.515 ' HB2' ' CE2' ' A' ' 34' ' ' TRP . 85.2 m -104.15 159.1 15.97 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.636 -179.141 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.473 ' O ' ' CE1' ' A' ' 48' ' ' TYR . 6.6 m -140.36 116.6 10.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.712 179.639 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.555 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 6.4 t -82.33 133.7 35.24 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.228 -179.569 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.473 ' CE1' ' O ' ' A' ' 46' ' ' THR . 7.1 m-85 -117.38 -27.08 6.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.629 179.864 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 138.67 174.14 13.31 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.227 -179.807 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -75.34 64.62 2.45 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.439 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -173.02 -64.29 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.792 0.33 . . . . 0.0 111.003 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -67.39 -24.95 65.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.242 -179.773 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 70.97 134.79 0.11 Allowed Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.216 -179.746 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.57 ' CD1' ' O ' ' A' ' 54' ' ' PHE . 4.8 p90 -69.98 132.66 46.26 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.942 0.401 . . . . 0.0 111.304 -179.692 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -108.39 140.54 41.53 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.237 179.542 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.505 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 2.4 m -126.63 176.01 7.53 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.992 0.425 . . . . 0.0 111.491 -179.529 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 177.52 -171.57 0.1 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.73 -179.912 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -56.9 141.71 44.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.952 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -73.16 119.27 74.81 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.965 179.929 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_exo -46.58 145.42 6.35 Favored 'Trans proline' 0 N--CA 1.464 -0.221 0 C-N-CA 122.722 2.281 . . . . 0.0 112.3 179.857 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.28 -30.87 70.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.827 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.534 ' HA ' ' HB2' ' A' ' 97' ' ' ALA . . . -135.04 153.65 51.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.967 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -111.84 -56.35 2.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.573 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 171.49 176.4 0.07 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.999 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 17.5 p 60.86 -177.65 0.11 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.224 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 20.2 t 176.2 129.17 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.854 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.547 ' CE1' ' HA ' ' A' ' 69' ' ' LYS . 53.2 t80 -85.39 108.07 17.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.007 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ASP . . . . . 0.464 ' O ' ' O ' ' A' ' 69' ' ' LYS . 1.2 t70 -81.34 85.75 6.37 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.737 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.547 ' HA ' ' CE1' ' A' ' 67' ' ' PHE . 0.3 OUTLIER -39.81 164.46 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.905 -179.941 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.503 ' CD1' ' N ' ' A' ' 70' ' ' TYR . 2.0 m-30 83.95 -46.31 0.11 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.892 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -111.87 -42.04 3.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.131 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' GLY . . . . . 0.443 ' HA2' ' CE2' ' A' ' 67' ' ' PHE . . . 90.34 5.62 69.58 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.554 -179.963 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 65.9 m-80 -74.01 105.82 5.42 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.845 0.355 . . . . 0.0 110.906 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 26.5 m -54.43 118.03 3.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.013 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.486 ' CE2' ' HB3' ' A' ' 81' ' ' TYR . 17.2 m-30 -110.05 177.58 4.67 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.696 179.894 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ARG . . . . . 0.476 ' HB2' ' HB2' ' A' ' 79' ' ' ASP . 0.6 OUTLIER -104.37 141.62 36.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.871 179.969 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.463 ' HA ' ' O ' ' A' ' 94' ' ' CYS . 9.0 p -47.8 -29.43 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.138 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -105.8 14.39 45.57 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.499 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 0.476 ' HB2' ' HB2' ' A' ' 76' ' ' ARG . 8.9 t70 -112.23 110.92 21.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.896 0.379 . . . . 0.0 110.887 -179.913 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.509 HG22 ' OG1' ' A' ' 93' ' ' THR . 2.7 p -81.89 150.46 27.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.158 179.983 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.537 ' OH ' HG21 ' A' ' 102' ' ' ILE . 11.6 p90 -123.17 -33.08 3.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.946 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.469 ' HB3' ' O ' ' A' ' 81' ' ' TYR . 30.7 tt0 76.44 165.75 0.25 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.92 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.4 ' HA ' ' HD2' ' A' ' 84' ' ' PRO . 0.2 OUTLIER -172.39 107.57 0.35 Allowed Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.742 179.964 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.401 ' HA ' ' HA ' ' A' ' 89' ' ' ILE . 49.4 Cg_endo -68.94 89.6 0.44 Allowed 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.716 2.277 . . . . 0.0 112.352 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 10.3 mttt -111.54 137.06 49.87 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.919 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 68.24 9.01 6.96 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.004 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.0 p 69.97 13.19 7.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.947 179.916 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.417 ' HB3' ' NE1' ' A' ' 90' ' ' TRP . 0.0 OUTLIER -102.1 -23.32 14.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.96 -179.933 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.405 ' O ' ' O ' ' A' ' 88' ' ' MET . 2.9 mp 59.31 122.29 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.12 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' TRP . . . . . 0.563 ' CH2' HD11 ' A' ' 106' ' ' ILE . 4.5 m95 -131.94 109.74 10.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.959 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -57.77 79.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.663 179.82 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' CYS . . . . . 0.702 ' SG ' HG22 ' A' ' 102' ' ' ILE . 0.5 OUTLIER -82.65 152.51 25.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.069 -179.782 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.509 ' OG1' HG22 ' A' ' 80' ' ' THR . 25.9 m -125.71 126.73 45.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.974 179.841 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.608 ' HA ' HD12 ' A' ' 102' ' ' ILE . 0.3 OUTLIER -57.83 80.11 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.024 -179.896 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.488 HG13 ' O ' ' A' ' 93' ' ' THR . 0.9 OUTLIER -97.57 141.43 15.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.199 179.975 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.432 ' HA3' ' HA3' ' A' ' 100' ' ' GLY . . . 127.36 162.74 11.23 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.436 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.534 ' HB2' ' HA ' ' A' ' 62' ' ' ALA . . . -96.94 57.92 1.55 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.78 0.324 . . . . 0.0 111.101 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.48 ' O ' ' CB ' ' A' ' 99' ' ' ARG . . . 92.72 7.99 62.52 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.506 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.48 ' CB ' ' O ' ' A' ' 98' ' ' GLY . 0.0 OUTLIER 162.21 38.88 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.88 0.371 . . . . 0.0 110.836 -179.92 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 0.432 ' HA3' ' HA3' ' A' ' 96' ' ' GLY . . . -76.8 -86.96 0.37 Allowed Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.491 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.558 ' N ' ' CD ' ' A' ' 101' ' ' ARG . 0.0 OUTLIER -176.12 94.91 0.06 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.831 0.348 . . . . 0.0 110.996 179.875 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.702 HG22 ' SG ' ' A' ' 92' ' ' CYS . 2.4 mm -58.59 99.43 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.951 179.734 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.416 ' C ' ' SG ' ' A' ' 92' ' ' CYS . 1.4 t -73.06 125.51 27.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.128 -179.82 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.472 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 59.2 m -108.32 164.17 12.55 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.834 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 3.2 t -178.27 149.45 0.53 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.181 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.563 HD11 ' CH2' ' A' ' 90' ' ' TRP . 5.0 mt -82.41 137.79 20.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.078 179.843 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -158.18 150.47 22.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.133 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' ASN . . . . . 0.482 ' O ' ' CB ' ' A' ' 109' ' ' ARG . 8.7 t30 179.49 59.29 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.918 -179.998 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 109' ' ' ARG . . . . . 0.482 ' CB ' ' O ' ' A' ' 108' ' ' ASN . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.244 -0.884 . . . . 0.0 110.887 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 83.7 p . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.785 0.326 . . . . 0.0 111.149 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.34 67.67 7.59 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.943 -179.789 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.48 ' O ' HG13 ' A' ' 30' ' ' ILE . 35.1 Cg_exo -61.33 -158.13 0.02 OUTLIER 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.897 2.398 . . . . 0.0 112.33 -179.947 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.469 ' HA2' HG13 ' A' ' 30' ' ' ILE . . . -70.73 -148.78 0.5 Allowed Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.443 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 81.0 m -134.83 93.76 3.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.912 0.387 . . . . 0.0 110.956 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -47.91 147.89 1.85 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.023 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.43 ' O ' ' CG ' ' A' ' 24' ' ' ASN . 14.2 t0 -178.3 131.85 0.14 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.767 179.977 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.43 ' CG ' ' O ' ' A' ' 23' ' ' ASP . 10.1 p30 51.04 22.92 1.34 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.989 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 88.64 -10.18 73.1 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.508 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.418 ' HB3' ' CZ ' ' A' ' 28' ' ' TYR . 0.1 OUTLIER -92.56 131.29 37.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.795 0.331 . . . . 0.0 110.835 179.963 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 14.7 t-160 -113.87 91.08 3.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.145 -179.704 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.469 ' O ' ' HA3' ' A' ' 20' ' ' GLY . 0.5 OUTLIER -79.76 176.9 9.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.802 179.837 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.529 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 0.0 OUTLIER -91.11 148.11 22.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.953 -179.946 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.692 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.7 mp -48.07 148.76 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.298 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 11.6 m-20 62.79 15.54 8.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.197 179.689 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.529 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 15.1 tt0 -98.14 150.36 21.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.804 0.335 . . . . 0.0 110.727 179.864 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.968 ' HG2' HG23 ' A' ' 46' ' ' THR . 8.8 mt-30 -110.21 156.17 21.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.086 -179.737 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' TRP . . . . . 0.584 ' CH2' ' O ' ' A' ' 46' ' ' THR . 48.6 p90 -162.56 -170.9 2.55 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.76 179.603 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -112.39 132.82 54.81 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.41 -179.581 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.521 ' O ' ' N ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -134.17 -174.1 3.45 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.22 179.548 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.444 ' HG1' ' C ' ' A' ' 41' ' ' ASN . 1.7 t -145.53 134.93 23.1 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.963 0.411 . . . . 0.0 111.312 179.942 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.462 ' CB ' HD22 ' A' ' 43' ' ' LEU . 1.6 t80 -128.95 122.75 30.85 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.597 179.696 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.443 ' CB ' ' O ' ' A' ' 38' ' ' TYR . 1.5 tp 78.85 8.71 1.96 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.663 -179.595 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 89.12 41.59 5.82 Favored Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.995 -0.622 . . . . 0.0 112.754 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.444 ' C ' ' HG1' ' A' ' 37' ' ' THR . 65.2 m-80 -152.14 136.85 17.01 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.681 0.277 . . . . 0.0 111.069 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.43 ' C ' ' O ' ' A' ' 41' ' ' ASN . . . -37.08 152.25 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.643 179.659 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.521 ' N ' ' O ' ' A' ' 36' ' ' ARG . 2.6 tp -167.15 156.56 10.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.02 0.438 . . . . 0.0 111.535 -179.537 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.505 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 15.2 t -110.09 155.54 11.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.693 178.927 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.574 ' SG ' ' CD1' ' A' ' 54' ' ' PHE . 0.1 OUTLIER -161.22 174.02 14.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.112 0.482 . . . . 0.0 111.6 -179.502 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.968 HG23 ' HG2' ' A' ' 33' ' ' GLN . 0.2 OUTLIER -138.79 -167.58 2.24 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.746 179.878 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.523 ' H ' HG22 ' A' ' 46' ' ' THR . 46.4 t -134.82 140.45 45.86 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.94 0.4 . . . . 0.0 111.019 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -110.54 -36.94 5.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.776 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.478 ' O ' ' N ' ' A' ' 51' ' ' SER . . . 127.18 163.66 11.49 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.406 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLY . . . . . 0.42 ' C ' ' O ' ' A' ' 49' ' ' GLY . . . 36.1 29.86 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.693 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.478 ' N ' ' O ' ' A' ' 49' ' ' GLY . 0.1 OUTLIER 49.65 35.24 8.35 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.86 0.362 . . . . 0.0 111.006 179.935 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.46 ' HG3' ' O ' ' A' ' 49' ' ' GLY . 9.7 mtp85 -58.83 -51.91 67.97 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.723 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 156.83 89.75 0.07 OUTLIER Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.613 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.574 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 1.8 p90 -58.17 -172.03 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.836 0.35 . . . . 0.0 110.813 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -136.13 114.09 11.29 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.76 179.89 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.505 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 13.3 m -94.61 -178.64 4.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.01 -179.855 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.504 ' O ' HD11 ' A' ' 43' ' ' LEU . 0.1 OUTLIER -171.95 -92.29 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.023 -179.996 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.485 ' HA ' ' HA ' ' A' ' 43' ' ' LEU . 0.2 OUTLIER 175.81 -177.16 0.12 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.914 -179.91 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 1.3 mmmt -90.87 159.51 40.14 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.915 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -49.01 177.49 0.02 OUTLIER 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.807 2.338 . . . . 0.0 112.339 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -138.68 18.0 2.69 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.812 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -123.05 117.4 25.36 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.004 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -88.07 107.64 18.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.635 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.457 ' HG2' ' O ' ' A' ' 64' ' ' GLU . 17.4 tt0 -177.29 39.54 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.889 179.969 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.406 ' C ' ' SG ' ' A' ' 66' ' ' CYS . 7.1 p -146.7 -166.16 2.42 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.129 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.473 ' O ' ' HB3' ' A' ' 67' ' ' PHE . 0.0 OUTLIER -157.02 -63.66 0.1 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.888 -179.934 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.473 ' HB3' ' O ' ' A' ' 66' ' ' CYS . 24.3 t80 79.76 92.25 0.05 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.806 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ASP . . . . . 0.89 ' OD1' HD13 ' A' ' 102' ' ' ILE . 0.6 OUTLIER -88.69 44.4 1.2 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.988 -179.96 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.606 ' HG3' ' CD1' ' A' ' 70' ' ' TYR . 2.2 ptmt 36.16 -144.52 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.728 179.836 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.606 ' CD1' ' HG3' ' A' ' 69' ' ' LYS . 9.4 m-30 79.95 -50.33 0.37 Allowed 'General case' 0 C--O 1.231 0.129 0 CA-C-O 120.722 0.296 . . . . 0.0 110.854 -179.687 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 5.3 t -171.37 -35.88 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.26 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 141.41 55.88 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.554 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 24.0 m-80 -104.44 49.53 0.81 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.738 0.304 . . . . 0.0 110.963 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.435 HG23 ' O ' ' A' ' 74' ' ' THR . 4.5 t -43.0 128.19 4.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.128 179.96 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.489 ' CE2' ' CE2' ' A' ' 81' ' ' TYR . 52.3 m-85 -108.06 -179.93 4.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.941 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 2.8 tpp180 -112.65 132.15 55.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.829 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.997 HG21 ' HB2' ' A' ' 97' ' ' ALA . 11.7 p -54.18 -19.5 3.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.091 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -111.7 34.96 4.96 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.529 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -154.1 125.62 7.53 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.888 0.375 . . . . 0.0 111.022 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 58.8 p -78.5 168.24 20.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.04 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.506 ' CZ ' ' CB ' ' A' ' 92' ' ' CYS . 22.3 p90 -166.38 167.47 15.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.859 -179.891 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.414 ' HB3' ' HA ' ' A' ' 91' ' ' ASP . 0.0 OUTLIER -138.99 132.45 30.25 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.849 179.89 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.423 ' HD2' ' OH ' ' A' ' 75' ' ' TYR . 3.3 mtp180 -136.2 140.91 34.26 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.023 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_endo -77.78 124.32 6.81 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.853 2.369 . . . . 0.0 112.327 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.535 ' O ' ' CB ' ' A' ' 86' ' ' ASP . 12.4 tppt? -129.27 108.37 10.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.879 179.845 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.535 ' CB ' ' O ' ' A' ' 85' ' ' LYS . 6.7 t0 87.86 -35.18 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.03 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.5 ' CB ' ' O ' ' A' ' 86' ' ' ASP . 0.4 OUTLIER 159.02 -23.33 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.771 -179.999 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -98.32 154.84 17.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.875 -179.889 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 14.0 mt -106.05 135.0 46.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.072 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' TRP . . . . . 0.611 ' CD1' ' N ' ' A' ' 90' ' ' TRP . 0.1 OUTLIER -130.23 130.78 45.07 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.832 179.955 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.414 ' HA ' ' HB3' ' A' ' 82' ' ' GLU . 60.2 m-20 -72.58 62.41 0.55 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.942 -179.878 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' CYS . . . . . 0.506 ' CB ' ' CZ ' ' A' ' 81' ' ' TYR . 57.1 m -48.91 145.23 4.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.0 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.445 ' O ' ' N ' ' A' ' 95' ' ' ILE . 10.6 m -132.15 125.42 31.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.038 179.843 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 45.3 t -61.59 77.87 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.854 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.445 ' N ' ' O ' ' A' ' 93' ' ' THR . 1.5 mt -90.75 84.55 2.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.307 -179.84 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 157.1 -23.4 0.46 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.455 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.997 ' HB2' HG21 ' A' ' 77' ' ' VAL . . . 59.56 44.09 15.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.855 0.36 . . . . 0.0 111.042 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 159.63 -55.69 0.34 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.528 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 178.99 44.65 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.809 0.337 . . . . 0.0 110.973 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -74.61 -64.81 2.28 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.489 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.512 ' O ' ' N ' ' A' ' 103' ' ' SER . 1.5 ptt180 -177.7 62.79 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.725 0.298 . . . . 0.0 110.94 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.89 HD13 ' OD1' ' A' ' 68' ' ' ASP . 13.2 mt -36.15 91.94 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.135 -179.93 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.512 ' N ' ' O ' ' A' ' 101' ' ' ARG . 0.3 OUTLIER -74.23 145.98 43.67 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.815 179.986 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 29.7 m -146.27 137.78 24.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.828 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 3.4 t -143.1 127.19 17.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.15 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.572 HG13 ' CE3' ' A' ' 90' ' ' TRP . 3.0 mt -41.6 126.01 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.033 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -107.49 105.78 15.85 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.07 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' ASN . . . . . 0.503 ' O ' ' CB ' ' A' ' 109' ' ' ARG . 4.6 m-20 -69.02 82.1 0.31 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.904 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' ARG . . . . . 0.503 ' CB ' ' O ' ' A' ' 108' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.195 -0.907 . . . . 0.0 110.9 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.402 0 CA-C-O 120.841 0.353 . . . . 0.0 111.112 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.65 94.53 31.91 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.937 -179.907 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -81.48 123.72 4.45 Favored 'Trans proline' 0 N--CA 1.462 -0.356 0 C-N-CA 122.901 2.401 . . . . 0.0 112.419 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.454 ' HA2' HG13 ' A' ' 30' ' ' ILE . . . 126.86 -173.88 18.26 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.682 -0.771 . . . . 0.0 112.611 179.934 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 3.3 m -145.91 91.76 2.12 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.852 0.358 . . . . 0.0 110.779 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -57.3 129.59 42.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.003 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.455 ' OD2' ' CE2' ' A' ' 54' ' ' PHE . 0.4 OUTLIER -161.65 135.17 6.47 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.82 179.98 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.424 ' CG ' ' O ' ' A' ' 24' ' ' ASN . 36.3 t30 62.28 38.96 12.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.865 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 60.47 17.45 47.72 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.622 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.578 ' HB3' ' CE1' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -133.05 137.82 46.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.848 0.356 . . . . 0.0 110.949 -179.985 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 51.9 t-80 -105.38 96.87 6.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.834 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.578 ' CE1' ' HB3' ' A' ' 26' ' ' LYS . 10.4 m-30 -79.68 170.54 16.38 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.804 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.489 ' O ' ' HB2' ' A' ' 32' ' ' GLN . 4.8 tm0? -89.93 130.98 36.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.504 179.742 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.65 HD12 ' H ' ' A' ' 30' ' ' ILE . 4.3 mp -33.99 148.22 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.924 0.393 . . . . 0.0 111.383 -179.845 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.423 ' HB2' ' O ' ' A' ' 30' ' ' ILE . 34.1 m-20 76.47 4.53 3.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.847 -179.672 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.489 ' HB2' ' O ' ' A' ' 29' ' ' GLN . 7.2 tp60 -91.08 134.38 34.56 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.582 179.712 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.449 ' O ' ' NE2' ' A' ' 32' ' ' GLN . 20.9 mt-30 -103.17 148.31 25.93 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.034 -179.792 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' TRP . . . . . 0.551 ' CZ2' ' HB3' ' A' ' 45' ' ' CYS . 35.5 p90 -157.28 179.01 9.67 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.672 179.886 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.69 ' OE2' ' HB1' ' A' ' 42' ' ' ALA . 0.2 OUTLIER -118.54 122.16 42.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.904 0.383 . . . . 0.0 111.377 -179.551 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.9 ' O ' HD22 ' A' ' 43' ' ' LEU . 3.8 ttt85 -114.59 141.53 47.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.528 179.592 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.532 ' CG2' ' N ' ' A' ' 38' ' ' TYR . 1.4 m -102.03 162.35 12.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.037 -179.782 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.532 ' N ' ' CG2' ' A' ' 37' ' ' THR . 13.0 t80 177.02 115.26 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.754 179.947 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.443 ' HA ' HD12 ' A' ' 39' ' ' LEU . 0.8 OUTLIER 74.66 34.43 0.74 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.831 -179.864 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 68.04 30.55 74.08 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.43 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.423 ' O ' ' HA ' ' A' ' 37' ' ' THR . 13.0 m120 -134.12 146.0 49.84 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 120.837 0.351 . . . . 0.0 110.962 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.892 ' C ' HD13 ' A' ' 43' ' ' LEU . . . -100.08 112.34 24.63 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.999 179.896 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.9 HD22 ' O ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -112.81 143.41 44.1 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.013 -179.989 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.497 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.7 t -93.7 126.9 46.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.348 179.261 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.57 ' SG ' ' CE1' ' A' ' 54' ' ' PHE . 6.2 m -105.64 166.94 10.1 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.698 -179.207 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.455 ' O ' ' HA ' ' A' ' 54' ' ' PHE . 26.0 m -150.49 124.47 9.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.679 179.642 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.485 ' SG ' ' HA ' ' A' ' 30' ' ' ILE . 15.1 t -79.79 130.39 35.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.032 -179.712 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -111.97 -25.59 9.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.93 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 94.58 -179.14 37.13 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.451 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 42.59 -129.69 5.0 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.59 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -89.33 -27.97 20.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.825 0.345 . . . . 0.0 110.979 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -49.69 -29.52 7.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.964 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 50.11 -125.37 19.95 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.629 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.57 ' CE1' ' SG ' ' A' ' 45' ' ' CYS . 1.1 p90 -132.85 160.2 37.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.829 0.347 . . . . 0.0 110.902 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -138.23 85.47 2.1 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.713 179.79 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.497 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.1 OUTLIER -63.3 158.9 19.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.045 -179.741 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -137.65 -70.13 0.44 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.844 179.921 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.484 ' HA ' ' HA ' ' A' ' 43' ' ' LEU . 85.0 p -172.59 176.86 3.12 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.822 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 46.3 tptt -102.62 101.53 20.91 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.78 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.477 ' HD3' ' O ' ' A' ' 58' ' ' SER . 53.2 Cg_exo -52.15 104.26 0.09 OUTLIER 'Trans proline' 0 C--N 1.342 0.21 0 C-N-CA 122.697 2.265 . . . . 0.0 112.361 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -38.26 -74.27 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.757 179.923 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -131.77 138.82 48.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.962 179.875 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.422 ' O ' ' N ' ' A' ' 65' ' ' THR . 1.3 tt0 -85.83 -47.12 10.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.43 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 87.9 mt-10 -62.33 78.59 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.806 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.422 ' N ' ' O ' ' A' ' 63' ' ' GLU . 7.3 p -142.45 150.67 40.88 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.189 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.422 ' SG ' ' HB2' ' A' ' 75' ' ' TYR . 0.3 OUTLIER -152.02 178.73 9.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.613 179.924 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 12.0 t80 -168.73 100.94 0.4 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.966 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ASP . . . . . 0.477 ' O ' ' O ' ' A' ' 69' ' ' LYS . 28.2 t0 -101.97 32.52 3.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.855 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.504 ' HD2' ' CE1' ' A' ' 70' ' ' TYR . 0.0 OUTLIER 39.07 -165.76 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.153 179.808 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.504 ' CE1' ' HD2' ' A' ' 69' ' ' LYS . 12.4 m-85 74.56 -54.62 0.67 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.131 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -127.33 -4.25 6.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.295 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 51.69 26.13 16.22 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.361 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ASN . . . . . 0.541 ' O ' ' CE1' ' A' ' 75' ' ' TYR . 35.7 t-20 -77.04 90.88 3.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.739 0.305 . . . . 0.0 110.965 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 56.2 m -49.52 119.41 3.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.036 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.541 ' CE1' ' O ' ' A' ' 73' ' ' ASN . 9.9 m-85 -102.95 172.8 6.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.818 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -111.92 133.55 54.04 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.781 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.447 ' HA ' ' HB3' ' A' ' 94' ' ' CYS . 53.1 t -49.4 -37.15 10.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.06 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -85.14 41.67 3.08 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.498 179.869 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -164.32 178.32 7.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.83 0.348 . . . . 0.0 110.993 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' THR . . . . . 1.052 HG22 HG23 ' A' ' 93' ' ' THR . 19.1 p -132.7 151.28 52.01 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.059 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 24.0 p90 -136.72 115.19 11.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.876 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -82.18 112.99 19.7 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.798 179.952 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.2 106.0 53.47 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.921 -179.924 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.466 ' HB3' HG12 ' A' ' 89' ' ' ILE . 71.5 Cg_endo -74.66 141.27 27.51 Favored 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.816 2.344 . . . . 0.0 112.303 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.462 ' O ' ' CB ' ' A' ' 86' ' ' ASP . 12.3 tptp -151.51 99.15 2.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.948 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.462 ' CB ' ' O ' ' A' ' 85' ' ' LYS . 0.3 OUTLIER 80.31 -167.54 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.907 -179.969 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.65 55.97 2.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.87 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 2.9 ptp -145.52 -60.97 0.34 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.881 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.466 HG12 ' HB3' ' A' ' 84' ' ' PRO . 60.9 mt 62.45 130.47 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.179 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' TRP . . . . . 0.614 ' CD1' ' N ' ' A' ' 90' ' ' TRP . 0.0 OUTLIER -137.65 172.76 12.48 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.884 179.971 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -110.24 82.68 1.63 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.902 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 23.2 m -68.77 135.05 50.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.981 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' THR . . . . . 1.052 HG23 HG22 ' A' ' 80' ' ' THR . 0.8 OUTLIER -115.91 174.76 5.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.924 179.782 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.633 ' H ' HG22 ' A' ' 93' ' ' THR . 36.7 t -108.99 40.27 1.85 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.87 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 2.0 mt -56.76 110.68 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.38 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 140.74 135.86 3.25 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.497 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -60.97 -14.77 24.98 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.838 0.352 . . . . 0.0 111.113 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.42 ' O ' ' HB3' ' A' ' 99' ' ' ARG . . . -144.08 24.98 2.07 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.535 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.624 ' HG2' HD11 ' A' ' 102' ' ' ILE . 4.5 tmm_? 64.8 132.22 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.843 0.354 . . . . 0.0 110.928 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 165.76 -36.04 0.26 Allowed Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.42 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 3.1 mtm-85 -102.52 43.12 1.09 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.832 0.348 . . . . 0.0 110.846 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.673 ' H ' HD12 ' A' ' 102' ' ' ILE . 5.2 mp -54.41 95.47 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.142 -179.821 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.72 124.66 28.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.649 179.774 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.523 ' SG ' HG22 ' A' ' 102' ' ' ILE . 4.1 m -129.04 121.96 28.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.994 -179.921 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 1.1 t -135.83 139.88 43.79 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.985 179.881 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.541 ' O ' ' HB2' ' A' ' 107' ' ' ALA . 2.6 mt -61.1 143.05 15.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.101 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.541 ' HB2' ' O ' ' A' ' 106' ' ' ILE . . . 171.6 117.79 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.116 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 12.2 p-10 -163.68 116.47 1.47 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.85 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 18.3 ttp180 . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.267 -0.873 . . . . 0.0 110.9 179.912 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.35 0 CA-C-O 120.835 0.35 . . . . 0.0 111.201 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.514 ' CG ' ' O ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -150.62 65.73 7.19 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.966 179.978 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -57.62 169.74 2.27 Favored 'Trans proline' 0 C--O 1.231 0.147 0 C-N-CA 122.694 2.263 . . . . 0.0 112.265 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 114.43 167.6 15.89 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.648 -0.786 . . . . 0.0 112.536 179.873 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 8.9 p -152.59 123.34 7.38 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.793 0.33 . . . . 0.0 110.847 -180.0 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 7.0 t80 -92.08 95.4 9.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.924 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.446 ' OD2' ' CE1' ' A' ' 54' ' ' PHE . 1.2 m-20 -117.0 139.61 50.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.821 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.464 ' OD1' ' O ' ' A' ' 24' ' ' ASN . 27.5 t-20 50.09 45.59 25.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.709 -179.959 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.12 16.86 28.09 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.363 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.95 152.56 47.74 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.818 0.342 . . . . 0.0 110.936 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 20.9 t-80 -116.85 97.97 6.25 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.136 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 15.6 m-85 -79.87 -178.72 6.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.854 179.849 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.495 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 2.1 tt0 -93.64 120.65 34.18 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.588 179.709 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.705 HD12 ' H ' ' A' ' 30' ' ' ILE . 4.4 mp -33.86 138.91 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.353 -179.825 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.488 ' N ' ' O ' ' A' ' 47' ' ' CYS . 34.3 m-20 76.97 5.35 3.31 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.762 -179.686 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.495 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 11.8 tt0 -86.61 154.19 21.22 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.774 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.965 ' CG ' HG23 ' A' ' 46' ' ' THR . 36.5 mt-30 -122.64 124.84 44.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.15 -179.683 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' TRP . . . . . 0.548 ' CZ3' ' HB2' ' A' ' 47' ' ' CYS . 22.9 p90 -131.0 175.63 8.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.791 179.742 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 33.6 tp10 -100.18 126.64 46.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.863 0.363 . . . . 0.0 111.313 -179.86 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.451 ' O ' ' O ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -138.25 -161.93 1.24 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.468 179.643 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.471 ' HG1' ' C ' ' A' ' 41' ' ' ASN . 2.2 t -143.83 141.46 30.37 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.952 0.406 . . . . 0.0 111.452 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.769 ' HB2' HD22 ' A' ' 43' ' ' LEU . 9.8 t80 -131.17 132.73 44.94 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.461 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.4 mp 63.44 16.96 9.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.947 0.404 . . . . 0.0 110.319 -179.53 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 83.41 37.07 12.74 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.938 -0.649 . . . . 0.0 112.563 -179.871 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.471 ' C ' ' HG1' ' A' ' 37' ' ' THR . 64.1 m-80 -146.55 139.7 25.58 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 120.77 0.319 . . . . 0.0 111.075 -179.9 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -48.04 134.19 14.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.835 179.739 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.845 HD12 ' O ' ' A' ' 57' ' ' GLU . 0.0 OUTLIER -165.36 147.44 7.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.02 0.438 . . . . 0.0 110.954 -179.752 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.465 ' O ' ' HB3' ' A' ' 56' ' ' CYS . 5.1 t -90.11 134.46 29.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.809 179.822 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.488 ' HA ' ' HA ' ' A' ' 56' ' ' CYS . 5.4 m -119.65 123.4 43.77 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.107 -179.706 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.965 HG23 ' CG ' ' A' ' 33' ' ' GLN . 0.2 OUTLIER -94.77 -174.04 3.17 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.003 179.868 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.659 ' H ' HG22 ' A' ' 46' ' ' THR . 27.8 t -138.69 119.8 14.55 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.85 0.357 . . . . 0.0 110.88 -179.843 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 9.9 m-30 -90.91 -46.32 8.25 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.261 -179.871 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 103.14 166.33 25.81 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.45 -179.737 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 65.31 -116.83 9.23 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.612 179.846 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 4.9 p -125.11 -6.85 7.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.731 0.301 . . . . 0.0 111.187 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 4.0 mtm180 -56.91 -29.28 62.91 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.897 0.379 . . . . 0.0 110.876 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 64.33 137.2 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.729 179.828 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.528 ' CB ' ' O ' ' A' ' 46' ' ' THR . 38.5 p90 -59.28 -167.8 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.574 0.226 . . . . 0.0 110.671 179.737 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.524 ' O ' ' CB ' ' A' ' 56' ' ' CYS . 2.3 t30 -147.16 -49.95 0.19 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.821 0.343 . . . . 0.0 111.601 -179.739 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.524 ' CB ' ' O ' ' A' ' 55' ' ' ASN . 5.2 m 85.62 -172.64 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.424 -179.611 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.845 ' O ' HD12 ' A' ' 43' ' ' LEU . 3.9 tt0 -156.78 -89.23 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.858 0.361 . . . . 0.0 111.359 -179.837 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.468 ' HA ' ' HA ' ' A' ' 43' ' ' LEU . 0.3 OUTLIER 170.97 146.44 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.835 -179.701 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.445 ' HA ' ' HD2' ' A' ' 60' ' ' PRO . 0.0 OUTLIER -39.83 116.3 1.15 Allowed Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.813 179.941 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.445 ' HD2' ' HA ' ' A' ' 59' ' ' LYS . 19.6 Cg_endo -60.89 -177.89 0.2 Allowed 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.702 2.268 . . . . 0.0 112.311 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -110.14 -63.37 1.39 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.976 -179.848 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -159.15 168.32 26.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.201 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.407 ' HG3' HG11 ' A' ' 77' ' ' VAL . 0.1 OUTLIER -115.46 123.19 47.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.55 -179.989 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -163.86 139.4 6.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.84 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.503 ' OG1' ' CG2' ' A' ' 74' ' ' THR . 12.6 p -57.95 -176.63 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.273 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 60.1 m -114.46 156.43 24.56 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.944 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 89.8 t80 -112.35 87.6 2.61 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.972 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.95 85.96 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.937 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 4.2 ptmt -41.08 -28.2 0.08 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.869 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 14.6 m-30 -40.02 -72.74 0.06 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.924 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.516 HG22 ' O ' ' A' ' 71' ' ' THR . 6.3 m -117.78 20.79 13.25 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.099 179.817 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 55.95 54.23 36.74 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.46 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ASN . . . . . 0.434 ' OD1' ' HB ' ' A' ' 71' ' ' THR . 0.4 OUTLIER -108.41 -162.9 0.84 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.763 0.316 . . . . 0.0 110.846 179.949 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.503 ' CG2' ' OG1' ' A' ' 65' ' ' THR . 1.1 m -146.01 133.05 20.3 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.065 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.443 ' O ' ' HB ' ' A' ' 65' ' ' THR . 2.7 m-85 -123.22 128.64 50.29 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.859 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 2.7 mmt180 -45.55 137.5 5.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.849 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.42 ' HA ' ' SG ' ' A' ' 94' ' ' CYS . 12.2 p -82.09 -17.03 11.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.194 -179.912 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -102.04 9.38 56.45 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.446 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -138.52 159.26 42.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.828 0.347 . . . . 0.0 110.896 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.497 ' OG1' ' N ' ' A' ' 81' ' ' TYR . 0.1 OUTLIER -106.59 -173.4 2.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.989 179.943 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.532 ' CZ ' ' HB3' ' A' ' 92' ' ' CYS . 15.2 p90 -164.74 -177.81 4.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.868 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -135.2 110.54 9.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.82 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.61 96.05 9.7 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.904 -179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -69.78 84.37 0.66 Allowed 'Trans proline' 0 C--O 1.231 0.145 0 C-N-CA 122.78 2.32 . . . . 0.0 112.227 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.87 139.37 32.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.91 179.887 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 46.32 -157.89 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.935 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.432 ' O ' ' HB2' ' A' ' 88' ' ' MET . 0.4 OUTLIER -84.03 62.8 7.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.931 -179.986 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.432 ' HB2' ' O ' ' A' ' 87' ' ' SER . 1.3 ttt 174.44 149.6 0.08 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.926 -179.944 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.534 ' C ' ' CD1' ' A' ' 90' ' ' TRP . 17.1 mt -110.37 157.79 10.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.124 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' TRP . . . . . 0.778 ' CZ3' HD11 ' A' ' 106' ' ' ILE . 0.1 OUTLIER -146.0 134.08 21.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.948 179.989 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 29.2 t0 -72.41 62.8 0.53 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.774 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' CYS . . . . . 0.532 ' HB3' ' CZ ' ' A' ' 81' ' ' TYR . 67.9 m -55.49 146.04 21.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.052 -179.87 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.477 ' O ' ' N ' ' A' ' 95' ' ' ILE . 21.2 m -144.03 141.31 30.04 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.96 179.806 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.42 ' SG ' ' HA ' ' A' ' 77' ' ' VAL . 50.3 t -66.29 60.21 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.975 -179.759 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.603 HD12 ' CB ' ' A' ' 103' ' ' SER . 2.6 mt -68.77 80.17 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.001 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -114.34 -107.15 2.71 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.462 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . 55.09 79.79 0.14 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.748 0.309 . . . . 0.0 111.085 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 82.65 -55.28 4.99 Favored Glycine 0 N--CA 1.453 -0.207 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.448 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 6.8 mtt180 -179.12 63.23 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.889 0.376 . . . . 0.0 110.965 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 0.459 ' O ' ' HB3' ' A' ' 101' ' ' ARG . . . -89.28 -28.21 20.73 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.528 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.517 ' N ' ' O ' ' A' ' 95' ' ' ILE . 0.0 OUTLIER 66.8 104.24 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.81 0.338 . . . . 0.0 110.9 179.952 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.476 HG21 ' OH ' ' A' ' 81' ' ' TYR . 2.5 mp -36.32 128.36 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.126 179.81 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.603 ' CB ' HD12 ' A' ' 95' ' ' ILE . 29.2 t -110.21 163.08 13.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.077 -179.911 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 82.3 m -154.49 119.9 5.09 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.935 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 22.1 m -133.45 124.7 27.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.167 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.778 HD11 ' CZ3' ' A' ' 90' ' ' TRP . 2.4 mp -58.79 87.67 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.116 179.965 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -108.28 141.95 39.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.197 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -79.74 134.15 36.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.935 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.814 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 44.3 m . . . . . 0 N--CA 1.486 1.346 0 CA-C-O 120.825 0.345 . . . . 0.0 111.214 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 60.3 83.51 0.21 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.907 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.466 ' C ' HD11 ' A' ' 30' ' ' ILE . 94.7 Cg_endo -79.0 84.34 2.07 Favored 'Trans proline' 0 N--CA 1.463 -0.297 0 C-N-CA 122.853 2.369 . . . . 0.0 112.386 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 176.81 -161.66 29.63 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.515 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -159.15 178.38 10.08 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.779 0.323 . . . . 0.0 110.878 -179.946 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 48.2 t80 -161.89 126.67 3.38 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.945 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -163.83 159.21 20.9 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.931 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 46.19 31.96 1.34 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.914 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 65.83 21.31 69.27 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.56 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.26 152.32 44.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.831 0.348 . . . . 0.0 110.91 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 1.3 t-80 -117.29 96.47 5.44 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.136 -179.689 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -88.53 -162.45 0.85 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.9 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.524 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 0.5 OUTLIER -124.83 156.7 37.4 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.756 179.868 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.679 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.5 mp -51.99 150.46 1.04 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.37 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.125 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 17.5 m-20 64.87 13.93 8.88 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.776 -179.871 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.524 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 12.9 tt0 -98.54 145.53 26.71 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.792 -179.979 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.727 ' HG2' HG23 ' A' ' 46' ' ' THR . 8.0 mt-30 -118.01 143.69 46.19 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.848 -179.78 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' TRP . . . . . 0.598 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 35.9 p90 -144.13 -172.07 3.69 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.829 179.83 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -116.08 133.14 56.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.928 0.394 . . . . 0.0 111.239 -179.814 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.4 171.24 14.77 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.502 179.72 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -134.69 142.8 46.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.937 0.398 . . . . 0.0 110.787 -179.841 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.502 ' CB ' HD22 ' A' ' 43' ' ' LEU . 0.7 OUTLIER -155.21 120.46 4.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.686 179.671 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.517 HD12 ' HA ' ' A' ' 39' ' ' LEU . 1.6 tp 80.91 22.62 0.36 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.58 -179.732 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 68.19 37.71 87.11 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.918 -0.658 . . . . 0.0 112.438 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.434 ' O ' ' C ' ' A' ' 42' ' ' ALA . 51.1 m-80 -148.35 133.37 18.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.667 0.27 . . . . 0.0 110.945 179.919 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.434 ' C ' ' O ' ' A' ' 41' ' ' ASN . . . -35.69 153.92 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.801 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.502 HD22 ' CB ' ' A' ' 38' ' ' TYR . 3.1 tp -161.52 146.05 13.2 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.144 -179.543 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.493 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 3.9 t -121.61 136.85 57.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.417 179.547 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.598 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 0.7 OUTLIER -116.41 161.39 19.14 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.322 -179.509 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.727 HG23 ' HG2' ' A' ' 33' ' ' GLN . 1.4 m -144.29 127.73 16.93 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.936 179.818 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.525 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 19.4 t -87.28 138.61 31.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.057 -179.868 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.554 ' C ' HG23 ' A' ' 30' ' ' ILE . 11.6 m-85 -122.4 -33.13 3.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.928 179.953 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.42 ' O ' ' HB2' ' A' ' 52' ' ' ARG . . . 64.75 -165.7 32.82 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.498 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLY . . . . . 0.501 ' O ' ' CB ' ' A' ' 51' ' ' SER . . . 56.65 31.13 60.19 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.523 -179.941 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.501 ' CB ' ' O ' ' A' ' 50' ' ' GLY . 0.8 OUTLIER 83.88 -10.01 0.95 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.706 0.289 . . . . 0.0 110.995 -179.978 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.42 ' HB2' ' O ' ' A' ' 49' ' ' GLY . 34.1 mtt85 -67.85 -46.78 70.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.021 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 92.47 -141.33 15.53 Favored Glycine 0 N--CA 1.446 -0.638 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.608 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.568 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 5.8 p90 -143.27 157.0 44.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.844 0.354 . . . . 0.0 110.92 -179.947 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 -131.57 124.89 30.97 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.809 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.493 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.5 OUTLIER -100.5 163.15 12.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.021 -179.963 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.466 ' O ' ' HA ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -175.02 -177.62 1.1 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.937 179.898 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -65.95 178.58 1.07 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.932 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.47 ' HD2' ' HD2' ' A' ' 60' ' ' PRO . 0.8 OUTLIER -78.17 157.37 78.4 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.891 179.992 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.47 ' HD2' ' HD2' ' A' ' 59' ' ' LYS . 74.7 Cg_exo -49.08 -65.99 0.15 Allowed 'Trans proline' 0 N--CA 1.465 -0.169 0 C-N-CA 122.826 2.35 . . . . 0.0 112.37 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.466 ' CB ' ' O ' ' A' ' 60' ' ' PRO . 24.2 tp10 162.44 -41.46 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.815 -179.957 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -89.22 121.97 32.04 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.072 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.406 ' O ' ' HB1' ' A' ' 97' ' ' ALA . 2.7 tt0 -57.4 -15.93 7.91 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.165 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.704 ' O ' HG23 ' A' ' 65' ' ' THR . 3.1 mt-10 -64.2 120.85 12.9 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.91 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.704 HG23 ' O ' ' A' ' 64' ' ' GLU . 0.2 OUTLIER 175.59 -171.82 0.07 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.116 179.952 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.834 ' O ' HG23 ' A' ' 74' ' ' THR . 4.1 t -178.27 169.17 1.87 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.923 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.413 ' O ' ' HB3' ' A' ' 68' ' ' ASP . 49.2 t80 -119.59 -52.95 2.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.959 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ASP . . . . . 0.414 ' HB3' ' O ' ' A' ' 73' ' ' ASN . 17.6 t70 71.8 84.04 0.13 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.876 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.495 ' O ' ' CB ' ' A' ' 70' ' ' TYR . 0.0 OUTLIER -57.53 -170.61 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.903 179.914 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.709 ' C ' HG22 ' A' ' 71' ' ' THR . 7.3 m-85 84.4 -4.2 1.03 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.05 -179.882 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.709 HG22 ' C ' ' A' ' 70' ' ' TYR . 0.0 OUTLIER 165.26 -26.22 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.2 -179.95 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 97.64 76.18 1.27 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.478 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ASN . . . . . 0.414 ' O ' ' HB3' ' A' ' 68' ' ' ASP . 2.6 m-20 -122.09 80.16 1.67 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.749 0.309 . . . . 0.0 110.96 179.954 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.834 HG23 ' O ' ' A' ' 66' ' ' CYS . 94.4 m -50.58 110.35 0.4 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.977 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.459 ' HB2' ' SG ' ' A' ' 94' ' ' CYS . 18.1 m-85 -108.68 164.08 12.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.646 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 4.2 mtt180 -78.83 117.37 19.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.952 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.46 ' HA ' ' O ' ' A' ' 94' ' ' CYS . 7.6 p -47.83 -22.69 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.191 -179.922 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -95.06 11.54 69.29 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.517 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -144.79 151.12 38.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.814 0.34 . . . . 0.0 110.962 179.961 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.982 HG22 HG23 ' A' ' 93' ' ' THR . 0.6 OUTLIER -96.72 -155.41 0.48 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.14 -179.921 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.532 ' O ' ' CB ' ' A' ' 82' ' ' GLU . 9.6 p90 -172.02 -35.13 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.069 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.532 ' CB ' ' O ' ' A' ' 81' ' ' TYR . 0.7 OUTLIER 87.29 157.6 0.07 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.897 179.9 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 2.7 mtt-85 178.44 119.01 0.19 Allowed Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.849 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.73 167.62 25.17 Favored 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.748 2.299 . . . . 0.0 112.477 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.436 ' O ' ' N ' ' A' ' 87' ' ' SER . 0.0 OUTLIER -171.8 150.46 2.65 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.649 179.976 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 56.8 -85.04 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.886 -179.857 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.436 ' N ' ' O ' ' A' ' 85' ' ' LYS . 0.4 OUTLIER -159.71 23.18 0.18 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.952 179.848 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.409 ' O ' ' CD1' ' A' ' 90' ' ' TRP . 0.0 OUTLIER -148.85 146.1 27.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.971 -179.854 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 10.4 mt -90.83 134.44 29.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.986 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' TRP . . . . . 0.559 ' CH2' HD11 ' A' ' 106' ' ' ILE . 1.0 OUTLIER -125.44 144.55 50.47 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.038 -179.901 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 57.9 m-20 -80.04 67.68 5.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.658 179.748 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 23.1 m -55.09 124.62 17.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.035 -179.857 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.982 HG23 HG22 ' A' ' 80' ' ' THR . 2.0 m -117.87 113.96 22.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.977 179.819 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.555 ' HA ' HD12 ' A' ' 102' ' ' ILE . 0.0 OUTLIER -54.41 87.62 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.878 -179.81 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.467 HG13 ' O ' ' A' ' 93' ' ' THR . 2.3 mt -117.2 95.52 3.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.196 -179.925 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.414 ' HA3' ' HA2' ' A' ' 100' ' ' GLY . . . -145.98 -94.39 0.16 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.616 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.406 ' HB1' ' O ' ' A' ' 63' ' ' GLU . . . 62.68 41.18 9.47 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.846 0.355 . . . . 0.0 111.06 -179.867 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 139.21 -27.32 2.65 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.554 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.61 -31.71 3.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.841 0.353 . . . . 0.0 110.912 -179.986 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 0.414 ' HA2' ' HA3' ' A' ' 96' ' ' GLY . . . 60.36 50.71 64.65 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.548 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 6.0 ptp180 -99.18 54.83 0.98 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.787 0.327 . . . . 0.0 110.928 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.555 HD12 ' HA ' ' A' ' 94' ' ' CYS . 5.4 mm -37.3 126.71 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.244 -179.986 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 5.9 t -99.14 131.06 45.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.888 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 24.3 m -135.4 117.45 15.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.031 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 7.3 t -130.86 161.25 32.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.123 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.559 HD11 ' CH2' ' A' ' 90' ' ' TRP . 3.2 mp -82.89 121.21 35.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.091 179.911 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -49.68 140.73 10.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.149 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 65.0 t-20 -88.76 -34.85 16.97 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.869 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' ARG . . . . . 0.446 ' OXT' ' HG3' ' A' ' 109' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.947 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 5.0 m . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.809 0.337 . . . . 0.0 111.12 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.413 ' O ' ' O ' ' A' ' 19' ' ' PRO . 0.6 OUTLIER -113.77 153.9 45.89 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.116 -179.952 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.413 ' O ' ' O ' ' A' ' 18' ' ' LYS . 73.4 Cg_exo -48.46 -176.07 0.0 OUTLIER 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 122.792 2.328 . . . . 0.0 112.3 179.901 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 96.66 -156.51 21.08 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.588 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 59.7 m -147.99 97.39 2.79 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.857 0.361 . . . . 0.0 110.847 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -64.97 150.03 48.72 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.826 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.466 ' OD1' ' O ' ' A' ' 26' ' ' LYS . 4.7 p-10 -133.86 -159.99 1.01 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.14 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.421 ' C ' ' O ' ' A' ' 23' ' ' ASP . 1.5 m-20 -34.45 -42.99 0.15 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.171 -179.816 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -173.15 32.11 0.11 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.598 -0.81 . . . . 0.0 112.611 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.592 ' HB3' ' CZ ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -139.93 134.92 32.26 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.815 0.34 . . . . 0.0 110.843 179.964 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 5.8 t-160 -114.21 86.77 2.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.892 -179.67 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.592 ' CZ ' ' HB3' ' A' ' 26' ' ' LYS . 1.6 m-85 -79.62 -168.96 1.74 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.0 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -105.92 165.53 11.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.792 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.702 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.1 mp -58.68 150.35 5.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.473 -179.772 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 67.5 m-80 61.04 13.34 4.56 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.118 179.785 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.405 ' O ' ' CZ3' ' A' ' 34' ' ' TRP . 12.4 tt0 -91.3 150.0 21.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.679 179.813 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.454 ' HG2' HG23 ' A' ' 46' ' ' THR . 11.8 mt-30 -114.41 145.02 42.37 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.137 -179.73 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' TRP . . . . . 0.585 ' CZ2' ' HB3' ' A' ' 45' ' ' CYS . 44.1 p90 -151.59 175.71 12.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.677 179.656 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -111.24 119.8 40.12 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.957 0.408 . . . . 0.0 111.455 -179.563 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.474 ' N ' ' O ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -110.7 -179.84 3.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.369 179.466 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.459 ' CG2' ' N ' ' A' ' 38' ' ' TYR . 1.0 OUTLIER -135.73 159.78 40.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.992 0.425 . . . . 0.0 110.975 -179.669 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.526 ' HB2' HD22 ' A' ' 43' ' ' LEU . 2.3 t80 -178.42 137.06 0.16 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.54 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.48 ' HA ' HD12 ' A' ' 39' ' ' LEU . 0.4 OUTLIER 59.04 27.55 16.52 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.613 -179.746 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 67.37 49.82 48.88 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.889 -0.672 . . . . 0.0 112.666 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 68.1 m-80 -152.52 167.14 29.79 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.818 0.342 . . . . 0.0 111.016 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.735 ' O ' HD12 ' A' ' 43' ' ' LEU . . . -86.54 131.46 34.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.75 179.693 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.735 HD12 ' O ' ' A' ' 42' ' ' ALA . 8.5 mp -127.85 155.45 44.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.319 -179.658 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.484 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 1.9 t -120.58 121.64 65.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.426 179.466 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.585 ' HB3' ' CZ2' ' A' ' 34' ' ' TRP . 1.3 m -106.99 163.29 13.1 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.281 -179.516 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.454 HG23 ' HG2' ' A' ' 33' ' ' GLN . 2.9 m -149.25 117.52 6.44 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.832 179.782 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.468 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 21.1 t -73.97 134.49 43.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.072 -179.811 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.542 ' CB ' ' HB3' ' A' ' 52' ' ' ARG . 6.8 m-85 -107.24 -29.7 9.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.863 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 100.27 168.0 29.07 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.451 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 48.99 -123.27 10.6 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.38 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -105.15 -4.53 21.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.764 0.316 . . . . 0.0 110.998 179.961 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.542 ' HB3' ' CB ' ' A' ' 48' ' ' TYR . 2.2 mtt85 -47.9 -28.16 2.51 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.905 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 60.13 146.7 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.592 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.564 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 22.9 p90 -74.96 177.7 6.13 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.732 0.301 . . . . 0.0 110.941 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -154.85 118.67 4.6 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.958 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.484 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.8 OUTLIER -103.08 150.74 23.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.874 179.942 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.445 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 0.3 OUTLIER -136.01 -86.08 0.35 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.906 -179.958 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.431 ' HA ' ' HA ' ' A' ' 43' ' ' LEU . 5.2 p -170.01 -166.05 0.53 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.96 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.437 ' HD2' ' C ' ' A' ' 59' ' ' LYS . 0.0 OUTLIER -146.45 93.85 4.91 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.878 -179.943 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -49.85 99.58 0.04 OUTLIER 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.782 2.321 . . . . 0.0 112.259 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -40.16 -29.62 0.08 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.064 -179.918 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -120.59 122.49 40.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.255 -179.977 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.567 ' O ' HG22 ' A' ' 65' ' ' THR . 1.8 tt0 -119.89 130.76 54.99 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.505 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.439 ' C ' HG22 ' A' ' 65' ' ' THR . 5.4 tt0 54.07 58.36 5.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.829 -180.0 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.567 HG22 ' O ' ' A' ' 63' ' ' GLU . 0.2 OUTLIER -160.81 -176.44 5.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.007 -179.998 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.495 ' N ' ' OG1' ' A' ' 65' ' ' THR . 0.6 OUTLIER -171.72 175.8 3.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.924 179.913 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.467 ' CE1' ' HA ' ' A' ' 69' ' ' LYS . 20.0 t80 -165.21 110.13 0.9 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.833 -179.961 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ASP . . . . . 0.559 ' O ' ' CD2' ' A' ' 70' ' ' TYR . 44.4 t0 -108.45 38.5 2.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.883 -179.947 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.584 ' HG3' ' CD1' ' A' ' 70' ' ' TYR . 4.3 ptmt 34.22 -154.13 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.078 179.988 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.584 ' CD1' ' HG3' ' A' ' 69' ' ' LYS . 15.5 m-85 75.29 -54.22 0.65 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.949 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -138.47 -62.43 0.57 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.244 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 132.53 44.9 0.14 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.572 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -88.95 74.06 8.24 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.795 0.331 . . . . 0.0 111.011 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 33.7 m -45.87 107.88 0.11 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.927 0.394 . . . . 0.0 111.029 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 -85.47 -157.98 0.35 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.884 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' ARG . . . . . 0.433 ' HB2' ' HB2' ' A' ' 79' ' ' ASP . 16.2 mtm180 -143.53 135.62 26.77 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.779 179.857 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 52.9 t -43.9 -28.06 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.055 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -109.53 31.03 7.91 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.424 179.813 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 0.433 ' HB2' ' HB2' ' A' ' 76' ' ' ARG . 0.6 OUTLIER -128.47 106.21 8.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.845 0.355 . . . . 0.0 110.829 179.998 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.618 HG23 HG23 ' A' ' 93' ' ' THR . 0.0 OUTLIER -85.94 118.96 25.74 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.144 -179.974 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.489 ' CZ ' ' HB3' ' A' ' 92' ' ' CYS . 30.1 p90 -120.06 173.87 6.83 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.753 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.446 ' HA ' ' O ' ' A' ' 90' ' ' TRP . 19.4 pt-20 -140.13 155.92 46.77 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.754 179.912 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.441 ' CZ ' ' HE2' ' A' ' 85' ' ' LYS . 0.0 OUTLIER -136.42 119.11 11.93 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.86 -179.929 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.66 95.09 0.62 Allowed 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.622 2.214 . . . . 0.0 112.242 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.441 ' HE2' ' CZ ' ' A' ' 83' ' ' ARG . 0.4 OUTLIER -146.81 163.76 34.99 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.905 -179.952 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 7.4 t0 56.21 49.51 15.23 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.832 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 9.3 m 43.54 31.17 0.4 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.923 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -159.18 175.56 13.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.892 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.458 ' O ' ' HA ' ' A' ' 106' ' ' ILE . 1.6 mp -126.27 134.17 67.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.158 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' TRP . . . . . 0.618 ' CD1' ' N ' ' A' ' 90' ' ' TRP . 0.0 OUTLIER -130.08 124.93 33.96 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.837 179.956 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.408 ' C ' ' O ' ' A' ' 81' ' ' TYR . 0.3 OUTLIER -78.93 71.14 5.37 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.993 -179.89 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 92' ' ' CYS . . . . . 0.489 ' HB3' ' CZ ' ' A' ' 81' ' ' TYR . 0.5 OUTLIER -45.97 136.42 6.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.895 179.808 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.618 HG23 HG23 ' A' ' 80' ' ' THR . 7.2 m -115.34 122.21 45.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.164 -179.906 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.452 ' SG ' ' O ' ' A' ' 96' ' ' GLY . 28.5 t -67.62 69.84 0.11 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.718 179.951 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -70.3 -7.88 9.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.408 -179.753 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.477 ' HA3' ' HA3' ' A' ' 100' ' ' GLY . . . -132.15 -165.6 11.35 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.55 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.419 ' HA ' ' O ' ' A' ' 65' ' ' THR . . . -140.3 -41.29 0.42 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.919 0.39 . . . . 0.0 110.927 179.912 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -152.88 17.42 0.73 Allowed Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.322 179.842 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 170.8 36.97 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.784 0.325 . . . . 0.0 110.957 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 0.477 ' HA3' ' HA3' ' A' ' 96' ' ' GLY . . . -97.8 -97.18 1.98 Allowed Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.563 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.496 ' O ' ' CG ' ' A' ' 101' ' ' ARG . 0.0 OUTLIER 170.55 75.17 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.792 0.33 . . . . 0.0 110.921 179.924 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 18.8 mt -58.14 79.55 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.085 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.481 ' N ' ' O ' ' A' ' 101' ' ' ARG . 9.6 t -58.65 167.82 1.38 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.033 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.415 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 0.0 OUTLIER -146.8 104.95 3.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.774 179.937 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 2.8 t -118.55 135.31 54.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.117 -179.896 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.48 ' HA ' ' HA ' ' A' ' 90' ' ' TRP . 2.4 mp -60.2 142.3 15.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.914 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -132.95 107.31 8.21 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.052 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' ASN . . . . . 0.417 ' O ' ' C ' ' A' ' 109' ' ' ARG . 32.0 t-20 -112.13 129.81 56.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.998 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 109' ' ' ARG . . . . . 0.417 ' C ' ' O ' ' A' ' 108' ' ' ASN . 1.0 OUTLIER . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.155 -0.926 . . . . 0.0 110.852 179.959 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 53.9 p . . . . . 0 N--CA 1.485 1.324 0 CA-C-O 120.829 0.347 . . . . 0.0 111.096 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.21 134.78 22.76 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.948 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -76.94 170.63 19.45 Favored 'Trans proline' 0 N--CA 1.464 -0.253 0 C-N-CA 122.738 2.292 . . . . 0.0 112.418 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 126.89 171.88 13.17 Favored Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.762 -0.733 . . . . 0.0 112.512 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 50.6 m -112.19 85.66 2.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.781 0.325 . . . . 0.0 110.793 -179.981 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -74.78 124.05 26.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.0 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.425 ' O ' ' CG ' ' A' ' 24' ' ' ASN . 0.3 OUTLIER -167.91 147.6 4.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.889 179.897 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.429 ' ND2' ' HB2' ' A' ' 26' ' ' LYS . 8.0 p-10 46.02 53.41 9.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.934 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 53.92 20.27 13.22 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.541 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.589 ' HB3' ' CZ ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -125.83 133.74 51.88 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.807 0.337 . . . . 0.0 111.004 -179.996 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 4.0 t-160 -117.97 84.18 2.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.956 -179.915 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.589 ' CZ ' ' HB3' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -79.91 167.88 19.95 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.79 179.906 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.483 ' O ' ' HB2' ' A' ' 32' ' ' GLN . 8.5 mt-30 -93.12 170.7 9.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.786 179.808 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.719 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.0 mp -65.49 153.74 8.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.338 -179.909 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 84.6 m-20 55.01 17.69 1.97 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.089 179.8 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.483 ' HB2' ' O ' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -97.1 139.26 33.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.816 179.809 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 11.7 mt-30 -107.01 148.66 28.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.872 -179.801 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' TRP . . . . . 0.534 ' CE2' ' CE1' ' A' ' 28' ' ' TYR . 38.8 p90 -165.75 -167.41 1.1 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.902 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.404 ' OE2' ' HE2' ' A' ' 59' ' ' LYS . 8.5 mt-10 -119.18 125.25 48.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.067 -179.786 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.481 ' O ' HD22 ' A' ' 43' ' ' LEU . 0.4 OUTLIER -121.6 123.39 41.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.55 179.714 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.483 ' HA ' ' O ' ' A' ' 41' ' ' ASN . 1.3 m -99.89 136.27 40.05 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.828 -179.565 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.812 ' CE1' HD13 ' A' ' 39' ' ' LEU . 5.8 t80 -152.04 142.76 22.86 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.707 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.812 HD13 ' CE1' ' A' ' 38' ' ' TYR . 0.0 OUTLIER 53.37 41.4 32.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.674 -179.761 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 60.3 50.56 66.3 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.521 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.483 ' O ' ' HA ' ' A' ' 37' ' ' THR . 60.0 m-80 -154.37 154.11 32.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.706 0.288 . . . . 0.0 111.024 179.993 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 1.019 ' C ' HD13 ' A' ' 43' ' ' LEU . . . -100.46 111.12 23.34 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.91 179.882 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 1.019 HD13 ' C ' ' A' ' 42' ' ' ALA . 0.0 OUTLIER -119.94 131.4 55.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.385 -179.631 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.505 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.4 t -77.83 128.61 38.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 178.762 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.561 ' SG ' ' CE1' ' A' ' 54' ' ' PHE . 1.5 m -110.1 144.19 39.07 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.014 0.435 . . . . 0.0 111.592 -179.151 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.449 ' O ' ' CD1' ' A' ' 48' ' ' TYR . 29.3 m -134.53 110.42 9.34 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.764 179.442 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.44 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 15.2 t -67.54 138.31 56.4 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.954 -179.691 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.526 ' O ' ' CG2' ' A' ' 30' ' ' ILE . 2.0 m-85 -105.38 -51.85 2.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.958 179.984 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 128.27 -179.69 16.4 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.427 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 41.15 -121.45 2.09 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.452 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -108.29 2.48 22.67 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.667 0.27 . . . . 0.0 111.093 -179.989 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.425 ' O ' ' O ' ' A' ' 53' ' ' GLY . 61.5 mtt180 -59.24 -42.09 90.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.944 179.986 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' GLY . . . . . 0.425 ' O ' ' O ' ' A' ' 52' ' ' ARG . . . 59.04 143.71 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.431 -179.921 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.561 ' CE1' ' SG ' ' A' ' 45' ' ' CYS . 1.3 p90 -58.03 150.28 21.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.943 0.401 . . . . 0.0 110.947 -179.926 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -104.46 -33.96 8.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.652 179.869 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.505 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.1 OUTLIER 59.27 148.29 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.051 179.864 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -130.08 -88.9 0.49 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.963 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.475 ' HA ' ' HA ' ' A' ' 43' ' ' LEU . 0.4 OUTLIER -158.0 -162.96 1.22 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.874 -179.967 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.503 ' O ' ' N ' ' A' ' 61' ' ' GLU . 0.0 OUTLIER -144.84 89.0 6.74 Favored Pre-proline 0 C--N 1.331 -0.217 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.974 -179.918 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_exo -57.56 72.23 0.04 OUTLIER 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.763 2.309 . . . . 0.0 112.214 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.503 ' N ' ' O ' ' A' ' 59' ' ' LYS . 2.0 pt-20 -70.85 -17.89 62.72 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.999 -179.933 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -82.67 112.55 19.64 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.15 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.441 ' CD ' ' CG2' ' A' ' 65' ' ' THR . 0.2 OUTLIER -62.65 -25.79 68.31 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.134 179.977 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 46.83 62.35 2.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.904 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.441 ' CG2' ' CD ' ' A' ' 63' ' ' GLU . 7.3 t -178.31 -160.11 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.189 -179.931 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.617 ' O ' HG23 ' A' ' 74' ' ' THR . 2.0 p -175.63 -178.0 1.04 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.869 -179.94 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -136.94 107.1 6.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.976 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ASP . . . . . 0.498 ' O ' ' N ' ' A' ' 72' ' ' GLY . 12.2 t70 -78.29 67.02 4.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.745 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.402 ' HG3' ' CD1' ' A' ' 70' ' ' TYR . 10.9 ptmt -41.27 -32.16 0.27 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.026 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.458 ' CD1' ' N ' ' A' ' 70' ' ' TYR . 1.7 m-30 -57.17 -33.13 67.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.858 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 3.9 m -126.46 -43.24 1.76 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.175 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' GLY . . . . . 0.498 ' N ' ' O ' ' A' ' 68' ' ' ASP . . . 111.37 1.61 27.89 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.476 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -89.22 111.69 22.55 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.731 0.3 . . . . 0.0 110.892 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.617 HG23 ' O ' ' A' ' 66' ' ' CYS . 55.5 m -64.81 128.67 36.73 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.018 179.878 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.448 ' CE2' ' HB2' ' A' ' 68' ' ' ASP . 27.7 m-85 -116.19 -171.65 2.03 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.769 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 5.7 ttt180 -103.24 129.97 50.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.808 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.441 ' HA ' ' O ' ' A' ' 94' ' ' CYS . 14.0 p -49.44 -36.63 10.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.211 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -78.2 5.92 52.7 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.525 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.17 119.44 37.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.854 0.359 . . . . 0.0 110.961 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -94.83 146.91 23.88 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.165 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.468 ' CE2' ' OD1' ' A' ' 68' ' ' ASP . 3.0 p90 -146.86 121.84 10.04 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.91 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.13 148.91 25.88 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.814 179.883 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.414 ' O ' ' HG2' ' A' ' 85' ' ' LYS . 0.0 OUTLIER -152.52 118.63 3.03 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.002 179.963 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.433 ' HA ' ' HA ' ' A' ' 89' ' ' ILE . 50.5 Cg_exo -53.81 85.93 0.03 OUTLIER 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 122.706 2.271 . . . . 0.0 112.22 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.452 ' O ' ' N ' ' A' ' 87' ' ' SER . 8.4 mmtm -87.59 160.94 18.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.976 -179.839 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 49.7 m-20 45.37 -92.02 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.022 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.452 ' N ' ' O ' ' A' ' 85' ' ' LYS . 1.4 m -143.83 20.65 1.81 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.963 -179.935 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 10.6 ttm -152.03 173.33 15.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.795 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.451 ' O ' ' HA ' ' A' ' 106' ' ' ILE . 1.8 mt -101.22 125.95 55.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.143 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' TRP . . . . . 0.622 ' CD1' ' N ' ' A' ' 90' ' ' TRP . 0.2 OUTLIER -126.14 130.29 50.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.854 -179.937 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.46 ' N ' ' O ' ' A' ' 105' ' ' THR . 24.7 t0 -65.59 63.61 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.838 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' CYS . . . . . 0.47 ' HA ' ' HA ' ' A' ' 104' ' ' CYS . 8.3 m -51.13 93.38 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.991 -179.91 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.475 ' N ' ' O ' ' A' ' 103' ' ' SER . 0.2 OUTLIER -82.9 130.26 35.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.021 179.936 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.441 ' O ' ' HA ' ' A' ' 77' ' ' VAL . 0.7 OUTLIER -75.91 56.89 1.0 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.997 -179.847 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.466 HG13 ' HB ' ' A' ' 93' ' ' THR . 2.0 mt -73.54 72.62 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.12 179.96 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -127.74 84.29 0.33 Allowed Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.563 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -121.99 80.71 1.73 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.852 0.358 . . . . 0.0 111.054 179.909 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 113.72 6.75 20.94 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.398 -179.835 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -164.86 -60.55 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.837 0.351 . . . . 0.0 110.854 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 114.45 80.19 0.91 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.475 -179.949 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.92 102.53 7.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.791 0.329 . . . . 0.0 110.942 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.57 ' N ' HD13 ' A' ' 102' ' ' ILE . 2.5 mm -85.1 76.36 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.159 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.475 ' O ' ' N ' ' A' ' 93' ' ' THR . 3.3 t -63.24 135.51 57.13 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.935 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.47 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 39.4 m -124.73 152.63 43.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.818 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 105' ' ' THR . . . . . 0.46 ' O ' ' N ' ' A' ' 91' ' ' ASP . 2.7 t -162.11 141.28 9.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.157 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.451 ' HA ' ' O ' ' A' ' 89' ' ' ILE . 0.8 OUTLIER -68.06 149.0 11.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.064 179.846 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -156.87 136.71 12.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.154 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -112.34 114.55 27.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.959 -179.915 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 11.0 mmt180 . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.153 -0.927 . . . . 0.0 110.899 179.856 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.5 t . . . . . 0 N--CA 1.487 1.415 0 CA-C-O 120.822 0.344 . . . . 0.0 111.15 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 41.5 mmtt -110.99 81.6 2.73 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.985 -179.888 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -79.36 124.16 5.79 Favored 'Trans proline' 0 N--CA 1.464 -0.248 0 C-N-CA 122.813 2.342 . . . . 0.0 112.436 179.972 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 119.82 168.44 13.86 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.706 179.958 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 98.0 m -118.42 109.85 16.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.806 0.336 . . . . 0.0 110.84 179.924 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 79.5 t80 -96.67 116.32 28.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.954 -179.904 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -159.22 153.51 23.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.885 -179.971 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.427 ' CG ' ' O ' ' A' ' 24' ' ' ASN . 23.7 t-20 55.89 33.65 22.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.896 179.998 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 68.42 12.8 64.29 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.555 -179.982 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.483 ' HB3' ' CE1' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -123.07 140.57 52.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.834 0.35 . . . . 0.0 110.918 179.983 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 5.6 t-160 -116.1 91.86 3.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.003 -179.826 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.582 ' CE2' ' CE2' ' A' ' 34' ' ' TRP . 0.1 OUTLIER -81.2 -179.2 7.25 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.019 179.932 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.519 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 0.0 OUTLIER -110.42 145.08 38.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.835 179.946 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.668 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.7 mp -41.26 148.27 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.395 -179.898 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.423 ' HB2' ' O ' ' A' ' 30' ' ' ILE . 71.5 m-80 66.63 12.92 9.09 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.136 179.801 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.519 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 56.1 tt0 -101.67 155.62 18.0 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.014 0.435 . . . . 0.0 111.23 -179.973 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.485 ' HG2' ' OG1' ' A' ' 46' ' ' THR . 23.2 mt-30 -119.34 158.83 25.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.632 179.944 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 34' ' ' TRP . . . . . 0.585 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 43.8 p90 -162.95 176.07 10.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.03 -179.964 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -107.11 113.69 27.3 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.087 -179.872 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.517 ' N ' ' O ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -97.48 178.18 5.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.805 179.92 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -147.39 140.58 25.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.667 -179.796 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 11.7 t80 -160.12 140.07 11.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.729 179.808 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 57.0 23.85 8.82 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.784 -179.879 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 75.52 32.86 53.95 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.888 -0.673 . . . . 0.0 112.747 179.819 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.454 ' O ' HD13 ' A' ' 43' ' ' LEU . 91.0 m-20 -136.38 148.36 47.79 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 120.875 0.369 . . . . 0.0 110.984 179.796 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.612 ' O ' HD12 ' A' ' 43' ' ' LEU . . . -71.65 133.82 45.94 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.767 179.841 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.612 HD12 ' O ' ' A' ' 42' ' ' ALA . 10.0 mp -126.44 153.34 45.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.358 -179.649 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.469 ' O ' ' HB3' ' A' ' 56' ' ' CYS . 2.2 t -113.02 124.14 69.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.026 -0.534 . . . . 0.0 109.904 179.033 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.585 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 9.4 m -113.28 161.71 16.89 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.902 -178.838 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.485 ' OG1' ' HG2' ' A' ' 33' ' ' GLN . 55.2 m -151.63 109.87 3.74 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.664 179.638 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.555 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 16.9 t -66.83 145.22 55.72 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.971 -179.765 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.484 ' CE1' ' O ' ' A' ' 46' ' ' THR . 4.0 m-85 -115.47 -42.51 3.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.852 -179.956 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 149.32 41.16 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.422 -179.901 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 49.42 47.49 35.6 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.487 -179.958 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 71.1 p -156.04 -58.9 0.1 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.841 0.353 . . . . 0.0 110.785 -179.977 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 13.7 mtp180 -75.96 1.17 16.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.078 179.984 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 62.35 116.89 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.743 -0.742 . . . . 0.0 112.519 179.948 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.567 ' CG ' ' O ' ' A' ' 54' ' ' PHE . 15.1 p90 -56.47 99.03 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.832 0.348 . . . . 0.0 110.836 179.976 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -72.45 140.56 48.36 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.955 -179.919 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.496 ' SG ' ' CD2' ' A' ' 54' ' ' PHE . 2.3 m -145.99 175.18 10.64 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.933 -179.916 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -171.03 -174.17 1.46 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.918 -179.95 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.414 ' O ' ' C ' ' A' ' 59' ' ' LYS . 5.0 p -79.77 136.24 36.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.876 179.993 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.414 ' C ' ' O ' ' A' ' 58' ' ' SER . 0.0 OUTLIER -36.69 107.85 0.38 Allowed Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.902 -179.927 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -48.68 -176.64 0.0 OUTLIER 'Trans proline' 0 N--CA 1.465 -0.165 0 C-N-CA 122.823 2.349 . . . . 0.0 112.262 179.876 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -133.06 6.3 3.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.137 179.978 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -46.85 97.93 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.898 0.38 . . . . 0.0 111.024 179.933 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -104.84 -20.52 13.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.697 -179.882 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.481 ' C ' HG22 ' A' ' 65' ' ' THR . 3.0 tt0 -73.62 88.09 1.68 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.887 -179.888 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.496 ' OG1' ' N ' ' A' ' 66' ' ' CYS . 0.5 OUTLIER -168.58 176.63 5.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.079 179.918 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.496 ' N ' ' OG1' ' A' ' 65' ' ' THR . 0.1 OUTLIER 177.53 -66.07 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.923 -179.949 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.438 ' O ' ' N ' ' A' ' 69' ' ' LYS . 46.2 t80 63.28 74.82 0.41 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.951 179.935 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 68' ' ' ASP . . . . . 0.514 ' O ' ' N ' ' A' ' 72' ' ' GLY . 15.0 t70 -41.27 95.19 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.85 179.982 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.438 ' N ' ' O ' ' A' ' 67' ' ' PHE . 2.2 pttm -57.11 -17.41 10.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.916 -179.926 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -65.84 -56.27 12.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.102 -179.866 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.99 7.04 14.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.277 -179.904 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 72' ' ' GLY . . . . . 0.514 ' N ' ' O ' ' A' ' 68' ' ' ASP . . . 59.77 31.62 72.15 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.382 179.947 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -84.05 -172.96 4.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.852 0.358 . . . . 0.0 110.773 179.93 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 15.8 m -111.03 79.06 1.16 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.968 179.925 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.456 ' CD2' ' HB2' ' A' ' 68' ' ' ASP . 11.1 m-30 -89.46 169.56 11.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.893 -179.99 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 76' ' ' ARG . . . . . 0.426 ' NE ' ' OE2' ' A' ' 64' ' ' GLU . 0.0 OUTLIER -128.01 135.97 50.63 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.766 -179.966 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.454 ' HA ' ' O ' ' A' ' 94' ' ' CYS . 2.3 p -48.53 -26.53 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.945 -179.965 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -90.1 8.25 80.14 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.513 -179.955 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -125.43 127.51 46.64 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.849 0.357 . . . . 0.0 110.787 179.966 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 5.0 t -103.35 150.8 23.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.148 -179.874 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.498 ' CG ' ' O ' ' A' ' 81' ' ' TYR . 25.9 p90 -140.84 112.09 7.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.824 179.844 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.486 ' CB ' ' OD1' ' A' ' 91' ' ' ASP . 6.1 pt-20 -86.12 136.12 33.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.974 -179.835 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.442 ' HA ' ' HD2' ' A' ' 84' ' ' PRO . 4.4 mtt180 -110.59 106.79 58.04 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.815 -179.991 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.451 ' HA ' HG12 ' A' ' 89' ' ' ILE . 34.0 Cg_endo -64.62 88.35 0.17 Allowed 'Trans proline' 0 C--O 1.231 0.156 0 C-N-CA 122.784 2.323 . . . . 0.0 112.283 179.983 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 2.4 mttm -126.74 126.32 43.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.934 179.995 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.491 ' CB ' ' SD ' ' A' ' 88' ' ' MET . 0.4 OUTLIER 67.92 177.42 0.25 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.841 179.905 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.2 m -84.99 55.58 3.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.945 -179.987 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.491 ' SD ' ' CB ' ' A' ' 86' ' ' ASP . 0.0 OUTLIER -150.23 -47.41 0.13 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.83 -179.947 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.484 ' C ' ' CD1' ' A' ' 90' ' ' TRP . 35.6 mt 62.76 137.4 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.839 179.97 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 90' ' ' TRP . . . . . 0.604 ' CD1' ' N ' ' A' ' 90' ' ' TRP . 0.1 OUTLIER -142.67 124.55 15.16 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.934 -179.881 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.486 ' OD1' ' CB ' ' A' ' 82' ' ' GLU . 93.8 m-20 -75.21 72.89 2.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.939 179.983 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 92' ' ' CYS . . . . . 0.476 ' HA ' ' O ' ' A' ' 103' ' ' SER . 0.1 OUTLIER -52.34 99.19 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.956 179.879 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 2.5 m -80.88 127.92 33.09 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.008 179.903 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.672 ' HA ' HD12 ' A' ' 102' ' ' ILE . 1.8 t -70.49 72.55 0.5 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.989 -179.856 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 1.9 mt -67.99 149.12 11.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.162 179.97 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -159.92 -102.82 0.18 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.644 -179.947 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . 48.69 37.78 10.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.836 0.351 . . . . 0.0 111.019 -179.914 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 120.43 -38.42 2.74 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.506 179.999 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.22 99.78 6.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.769 0.318 . . . . 0.0 110.882 -179.926 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -69.96 77.62 0.41 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.433 179.93 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -120.8 93.73 4.12 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.805 0.336 . . . . 0.0 110.961 -179.983 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.672 HD12 ' HA ' ' A' ' 94' ' ' CYS . 6.6 mm -60.75 123.91 14.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.124 179.906 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.476 ' O ' ' HA ' ' A' ' 92' ' ' CYS . 25.3 t -105.93 125.81 51.44 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.991 -179.92 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.45 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 0.5 OUTLIER -102.27 86.5 2.84 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.962 -179.924 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 4.7 t -73.12 131.75 42.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.113 179.918 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.575 ' HB ' ' CZ3' ' A' ' 90' ' ' TRP . 0.9 OUTLIER -62.87 148.78 10.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.959 179.794 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.451 ' HB3' ' O ' ' A' ' 88' ' ' MET . . . -77.6 168.52 19.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.019 179.941 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -175.54 145.1 0.71 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.891 -179.961 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 4.1 mtt180 . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.855 -179.98 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.503 ' OG ' ' N ' ' A' ' 18' ' ' LYS . 14.1 t . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.837 0.351 . . . . 0.0 111.095 . . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.503 ' N ' ' OG ' ' A' ' 17' ' ' SER . 44.0 tttt -155.35 129.75 4.86 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.983 179.952 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 18' ' ' LYS . 39.6 Cg_exo -57.1 -165.33 0.02 OUTLIER 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.888 2.392 . . . . 0.0 112.256 179.943 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.527 ' H ' HD11 ' A' ' 30' ' ' ILE . . . 82.33 122.87 0.72 Allowed Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.572 179.947 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.483 ' O ' ' HB2' ' A' ' 22' ' ' TYR . 11.7 m -79.49 -179.91 7.09 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.83 0.347 . . . . 0.0 110.752 179.781 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.483 ' HB2' ' O ' ' A' ' 21' ' ' CYS . 85.7 t80 174.93 119.35 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.919 179.942 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -153.95 156.89 38.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.856 -179.996 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.4 ' CG ' ' O ' ' A' ' 24' ' ' ASN . 29.3 t-20 48.35 27.47 1.37 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.88 -179.943 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.06 -3.55 70.56 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.523 179.965 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.586 ' HB3' ' CZ ' ' A' ' 28' ' ' TYR . 0.9 OUTLIER -91.95 135.52 33.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.837 0.351 . . . . 0.0 110.852 -179.986 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 3.9 t-160 -113.47 90.82 3.44 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.997 -179.984 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.586 ' CZ ' ' HB3' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -84.98 142.61 29.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.988 179.938 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.526 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 20.2 mt-30 -76.39 147.0 38.32 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.587 179.771 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.828 HD13 ' SG ' ' A' ' 47' ' ' CYS . 7.6 mm -49.5 147.59 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.961 0.41 . . . . 0.0 110.982 179.979 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.431 ' CG ' HG22 ' A' ' 30' ' ' ILE . 61.3 m-20 67.1 7.77 5.67 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.042 179.956 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.526 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 1.5 tt0 -92.76 151.79 19.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.849 0.356 . . . . 0.0 110.9 179.932 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -124.8 136.54 53.92 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.043 -179.826 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 34' ' ' TRP . . . . . 0.595 ' CZ3' ' HB2' ' A' ' 47' ' ' CYS . 19.3 p90 -134.86 -170.96 2.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.759 179.876 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.5 ' HG3' HG22 ' A' ' 44' ' ' VAL . 2.2 mt-10 -130.76 125.17 33.12 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.922 0.391 . . . . 0.0 111.159 -179.868 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.47 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 0.1 OUTLIER -122.85 172.89 8.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.74 179.742 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -126.37 143.94 51.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.757 -179.769 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -155.92 125.45 6.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.611 179.769 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 74.36 14.61 3.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.522 -179.879 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 80.01 45.49 8.27 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.611 -179.957 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 9.1 m120 -149.46 168.33 23.74 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 120.789 0.328 . . . . 0.0 110.995 179.865 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.783 ' C ' HD12 ' A' ' 43' ' ' LEU . . . -82.82 132.08 35.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.953 179.805 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.783 HD12 ' C ' ' A' ' 42' ' ' ALA . 10.3 mp -136.52 146.28 46.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.972 0.415 . . . . 0.0 111.311 -179.718 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.5 HG22 ' HG3' ' A' ' 35' ' ' GLU . 2.4 t -114.74 130.6 68.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.139 179.05 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.593 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 1.3 m -112.06 166.54 11.15 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.096 0.474 . . . . 0.0 111.537 -179.323 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.467 ' O ' ' HB2' ' A' ' 54' ' ' PHE . 27.9 m -143.52 147.56 34.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.663 -0.698 . . . . 0.0 110.69 179.704 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.828 ' SG ' HD13 ' A' ' 30' ' ' ILE . 21.9 t -106.88 143.91 34.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.937 -179.825 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.44 ' CD1' ' N ' ' A' ' 48' ' ' TYR . 3.1 m-85 -130.37 -47.08 1.08 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.919 179.906 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 99.91 -50.22 1.12 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.793 -0.718 . . . . 0.0 112.428 -179.921 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -70.46 -152.88 0.91 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.486 179.913 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.12 -6.14 45.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.7 0.286 . . . . 0.0 111.016 179.986 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 1.3 mtt180 -62.68 -38.25 89.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.106 -179.932 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 61.42 155.82 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.657 -0.782 . . . . 0.0 112.303 -179.887 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.558 ' CE1' ' SG ' ' A' ' 45' ' ' CYS . 0.2 OUTLIER -72.88 126.59 30.29 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.794 0.33 . . . . 0.0 110.818 -179.966 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 43.9 m-80 -120.47 118.27 29.84 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.767 179.97 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.49 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.1 OUTLIER -89.28 167.27 13.2 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.061 -179.837 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -151.24 151.04 31.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.836 179.938 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.462 ' O ' ' O ' ' A' ' 59' ' ' LYS . 4.9 p -72.19 77.94 0.97 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.968 -179.933 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.462 ' O ' ' O ' ' A' ' 58' ' ' SER . 12.3 tptt 38.69 97.08 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.048 179.883 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.412 ' HD2' ' HA ' ' A' ' 59' ' ' LYS . 50.5 Cg_endo -69.24 -167.31 0.2 Allowed 'Trans proline' 0 N--CA 1.465 -0.164 0 C-N-CA 122.825 2.35 . . . . 0.0 112.275 179.882 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -134.55 24.89 3.75 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.947 179.91 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -52.71 145.24 12.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.073 179.959 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -90.1 122.53 33.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.481 179.944 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.507 ' HB3' HG11 ' A' ' 77' ' ' VAL . 1.8 mp0 -151.53 122.31 7.52 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.964 -179.866 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.459 ' O ' ' HA3' ' A' ' 96' ' ' GLY . 0.0 OUTLIER -173.91 -172.01 0.69 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.0 179.96 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.459 ' O ' HG23 ' A' ' 74' ' ' THR . 1.7 p -171.5 171.47 5.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.961 179.959 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -160.6 106.74 1.49 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.027 179.998 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 50.2 t0 -70.44 88.05 0.65 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.825 179.965 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.426 ' O ' ' C ' ' A' ' 70' ' ' TYR . 0.5 OUTLIER -59.35 -37.44 77.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.997 -179.975 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.426 ' C ' ' O ' ' A' ' 69' ' ' LYS . 10.5 m-30 -36.13 -40.57 0.22 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.863 179.949 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 91.2 m -121.58 -30.45 4.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.138 179.88 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 107.18 14.14 19.39 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.37 -179.924 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 15.4 m-20 -92.73 176.81 6.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.923 0.392 . . . . 0.0 110.967 179.981 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.459 HG23 ' O ' ' A' ' 66' ' ' CYS . 90.0 m -132.85 136.41 46.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.959 179.88 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.459 ' CD2' ' CE2' ' A' ' 81' ' ' TYR . 34.7 m-85 -128.38 -170.72 2.3 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.74 -179.972 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 31.1 mtt-85 -99.18 124.52 44.3 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.808 179.921 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.507 HG11 ' HB3' ' A' ' 64' ' ' GLU . 7.3 p -54.0 -27.27 15.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.169 -179.93 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -79.83 -4.99 89.63 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.578 -179.979 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -123.17 -174.52 2.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.833 0.349 . . . . 0.0 110.98 -179.989 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 13.6 t -144.63 -174.68 4.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.979 -179.98 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.459 ' CE2' ' CD2' ' A' ' 75' ' ' TYR . 33.3 p90 -159.92 153.85 23.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.952 179.963 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 54.4 tt0 -82.88 140.77 32.69 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.875 179.98 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.43 110.43 9.7 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.971 -179.883 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -74.32 98.36 1.1 Allowed 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 122.736 2.291 . . . . 0.0 112.381 179.977 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.402 ' O ' ' CB ' ' A' ' 86' ' ' ASP . 0.1 OUTLIER -131.55 123.26 27.59 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.91 -179.993 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.402 ' CB ' ' O ' ' A' ' 85' ' ' LYS . 2.6 t0 77.31 -155.18 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.924 179.954 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 59.3 p -85.26 -3.24 58.75 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.125 179.925 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 2.7 tpt -128.09 163.91 23.58 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.889 -179.949 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.514 ' C ' ' CD1' ' A' ' 90' ' ' TRP . 2.3 mp -106.23 152.45 7.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.052 179.88 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 90' ' ' TRP . . . . . 0.618 ' CD1' ' N ' ' A' ' 90' ' ' TRP . 0.1 OUTLIER -143.81 141.81 30.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.963 -179.986 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -91.34 70.85 6.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.924 179.963 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 92' ' ' CYS . . . . . 0.426 ' HA ' ' HA ' ' A' ' 104' ' ' CYS . 72.1 m -47.9 99.95 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.039 -179.958 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.513 ' O ' HG23 ' A' ' 102' ' ' ILE . 0.2 OUTLIER -71.26 122.29 19.97 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.879 179.896 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -63.76 86.47 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.938 -179.84 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.833 HG22 ' CA ' ' A' ' 100' ' ' GLY . 1.1 mt -100.0 102.11 13.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.147 -179.948 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.624 ' O ' ' HB3' ' A' ' 97' ' ' ALA . . . -112.08 -136.53 6.86 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.706 -179.969 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.624 ' HB3' ' O ' ' A' ' 96' ' ' GLY . . . 79.76 -157.46 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.632 0.253 . . . . 0.0 110.875 -179.776 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -42.36 -30.83 0.87 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.515 -0.85 . . . . 0.0 112.204 179.871 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.51 ' O ' ' N ' ' A' ' 101' ' ' ARG . 3.9 ttp180 -155.69 -55.03 0.09 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.846 0.355 . . . . 0.0 110.377 179.824 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 0.833 ' CA ' HG22 ' A' ' 95' ' ' ILE . . . 58.14 -75.22 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.952 -0.642 . . . . 0.0 112.779 179.667 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.521 ' CD ' ' O ' ' A' ' 101' ' ' ARG . 0.0 OUTLIER 69.11 87.07 0.12 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.831 0.348 . . . . 0.0 110.494 -179.733 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.599 ' H ' HD12 ' A' ' 102' ' ' ILE . 3.7 mp -41.2 122.13 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.18 179.96 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.475 ' HB2' ' NH2' ' A' ' 101' ' ' ARG . 19.5 t -105.38 133.01 50.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.929 -179.913 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.426 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 38.3 m -112.32 132.1 55.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.883 179.902 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 105' ' ' THR . . . . . 0.412 ' O ' ' HA ' ' A' ' 90' ' ' TRP . 5.0 t -140.72 143.67 35.14 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.216 -179.931 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.466 ' HA ' ' O ' ' A' ' 89' ' ' ILE . 5.8 mt -47.91 155.24 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.902 179.919 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.429 ' N ' ' CG2' ' A' ' 106' ' ' ILE . . . -90.59 111.95 23.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.059 -179.99 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -92.65 154.52 18.32 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.863 -179.941 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 15.1 ptt85 . . . . . 0 C--O 1.248 0.985 0 CA-C-O 118.273 -0.87 . . . . 0.0 110.875 -179.919 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.414 ' O ' ' C ' ' A' ' 18' ' ' LYS . 3.5 t . . . . . 0 N--CA 1.486 1.334 0 CA-C-O 120.836 0.35 . . . . 0.0 111.284 . . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.414 ' C ' ' O ' ' A' ' 17' ' ' SER . 0.0 OUTLIER 36.82 67.65 1.7 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.958 179.956 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.433 ' HB2' HD11 ' A' ' 30' ' ' ILE . 32.5 Cg_exo -57.74 157.42 23.74 Favored 'Trans proline' 0 C--N 1.341 0.136 0 C-N-CA 122.771 2.314 . . . . 0.0 112.178 179.997 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 152.18 -162.06 29.64 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.514 -179.976 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 17.1 m -152.67 97.92 2.29 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.916 0.388 . . . . 0.0 110.819 179.979 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -71.83 135.21 46.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.982 -179.986 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.411 ' HB3' ' ND2' ' A' ' 24' ' ' ASN . 0.2 OUTLIER -157.48 121.98 4.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.95 179.995 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.411 ' ND2' ' HB3' ' A' ' 23' ' ' ASP . 3.1 p30 44.62 47.42 8.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.048 179.934 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 71.11 2.17 45.79 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.638 179.924 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.403 ' HB3' ' CZ ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -103.26 133.33 48.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.834 0.349 . . . . 0.0 110.906 179.961 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -116.73 91.94 3.73 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.963 -179.769 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.598 ' CE2' ' CE2' ' A' ' 34' ' ' TRP . 3.2 m-85 -79.79 130.52 35.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.946 -179.955 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.47 ' O ' ' HB2' ' A' ' 32' ' ' GLN . 3.2 tt0 -63.25 135.05 56.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.599 179.891 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.717 HG23 ' C ' ' A' ' 48' ' ' TYR . 4.2 mp -31.85 139.07 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.512 -179.924 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.476 ' N ' ' O ' ' A' ' 47' ' ' CYS . 61.0 m-20 78.11 0.74 2.72 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.124 -179.78 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.47 ' HB2' ' O ' ' A' ' 29' ' ' GLN . 6.3 mm100 -76.94 141.71 40.36 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.819 0.342 . . . . 0.0 110.885 179.81 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 33' ' ' GLN . . . . . 0.487 ' HG2' HG23 ' A' ' 46' ' ' THR . 11.4 mt-30 -114.13 132.33 56.1 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.037 -179.962 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 34' ' ' TRP . . . . . 0.598 ' CE2' ' CE2' ' A' ' 28' ' ' TYR . 42.6 p90 -148.61 -168.46 3.1 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.921 -179.935 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -122.44 132.78 54.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.967 -179.799 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 1.0 ' O ' HD22 ' A' ' 43' ' ' LEU . 0.4 OUTLIER -119.95 167.56 12.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.773 179.879 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.776 HG22 ' O ' ' A' ' 41' ' ' ASN . 0.1 OUTLIER -109.43 164.23 12.69 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.086 -179.86 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.582 ' HB2' HD21 ' A' ' 43' ' ' LEU . 0.1 OUTLIER -156.14 93.01 1.39 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.651 179.91 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.45 HD13 ' HA ' ' A' ' 39' ' ' LEU . 0.8 OUTLIER 67.2 18.59 10.36 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.694 -179.707 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 107.11 8.97 30.67 Favored Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.62 179.996 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.776 ' O ' HG22 ' A' ' 37' ' ' THR . 50.1 m-80 -94.78 -173.11 2.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.852 0.358 . . . . 0.0 111.018 -179.908 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.957 ' C ' HD13 ' A' ' 43' ' ' LEU . . . -135.48 107.83 7.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.924 179.844 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 1.0 HD22 ' O ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -121.89 157.59 30.85 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.156 -179.889 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.467 ' O ' ' HB3' ' A' ' 56' ' ' CYS . 2.8 t -95.8 132.09 40.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.176 -0.466 . . . . 0.0 109.934 179.122 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.54 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 1.8 m -114.29 157.17 23.12 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.738 -179.092 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.487 HG23 ' HG2' ' A' ' 33' ' ' GLN . 4.6 m -146.18 130.81 17.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.599 179.545 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.51 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 20.0 t -83.79 139.16 32.87 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.029 -179.644 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.717 ' C ' HG23 ' A' ' 30' ' ' ILE . 5.5 m-85 -119.56 -14.93 9.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.967 -179.925 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.517 ' HA2' ' CG1' ' A' ' 30' ' ' ILE . . . 132.09 -165.22 23.6 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.557 179.94 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 50' ' ' GLY . . . . . 0.514 ' O ' ' CB ' ' A' ' 51' ' ' SER . . . -91.98 67.09 2.12 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.534 -179.977 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.514 ' CB ' ' O ' ' A' ' 50' ' ' GLY . 0.1 OUTLIER 159.66 -51.73 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.756 0.312 . . . . 0.0 110.908 179.99 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 9.5 mtt-85 -57.27 -19.08 19.54 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.904 179.925 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 53' ' ' GLY . . . . . 0.472 ' O ' ' CD1' ' A' ' 48' ' ' TYR . . . 73.54 172.46 24.76 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.597 179.832 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.577 ' CG ' ' O ' ' A' ' 54' ' ' PHE . 11.3 p90 -114.23 96.59 5.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.828 0.346 . . . . 0.0 110.838 179.989 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 61.0 m-20 -71.14 138.31 49.54 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.708 179.991 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.506 ' SG ' ' CD2' ' A' ' 54' ' ' PHE . 3.0 m -144.2 162.11 37.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.942 0.401 . . . . 0.0 111.231 -179.648 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.458 ' O ' ' O ' ' A' ' 58' ' ' SER . 0.5 OUTLIER -162.72 160.9 26.03 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.771 179.857 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.458 ' O ' ' O ' ' A' ' 57' ' ' GLU . 0.6 OUTLIER -37.3 161.01 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.945 179.993 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -103.2 107.57 55.97 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.034 -179.932 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -76.56 124.52 7.69 Favored 'Trans proline' 0 N--CA 1.464 -0.228 0 C-N-CA 122.82 2.347 . . . . 0.0 112.416 -179.994 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -111.09 -23.82 10.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.703 179.858 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -131.52 125.45 32.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.004 179.886 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -91.01 -27.09 18.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.609 -179.972 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.762 ' O ' HG23 ' A' ' 65' ' ' THR . 5.8 tt0 66.26 114.37 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.921 179.86 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.762 HG23 ' O ' ' A' ' 64' ' ' GLU . 0.2 OUTLIER 171.82 169.33 0.1 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.195 179.985 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.442 ' HB2' ' C ' ' A' ' 75' ' ' TYR . 0.8 OUTLIER -153.05 -175.09 5.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.783 179.98 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -129.78 -37.22 1.55 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.943 -179.928 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 68' ' ' ASP . . . . . 0.445 ' O ' ' O ' ' A' ' 69' ' ' LYS . 27.3 t0 59.98 63.99 1.35 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.806 179.997 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.445 ' O ' ' O ' ' A' ' 68' ' ' ASP . 9.7 ptmt -45.44 176.07 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.882 179.98 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.872 ' O ' HG23 ' A' ' 71' ' ' THR . 20.4 m-85 65.37 17.78 11.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.955 -179.997 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.872 HG23 ' O ' ' A' ' 70' ' ' TYR . 0.7 OUTLIER -177.75 -34.47 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.218 -179.994 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 80.04 42.62 10.64 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.553 -179.991 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 73' ' ' ASN . . . . . 0.409 ' O ' ' CB ' ' A' ' 68' ' ' ASP . 0.1 OUTLIER -100.58 116.12 31.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.791 0.329 . . . . 0.0 110.855 179.97 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.43 ' O ' ' NH2' ' A' ' 76' ' ' ARG . 5.2 m -70.61 100.47 1.84 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.101 179.957 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.442 ' C ' ' HB2' ' A' ' 66' ' ' CYS . 3.9 m-30 -92.29 -174.49 3.74 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.853 -179.953 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 76' ' ' ARG . . . . . 0.43 ' NH2' ' O ' ' A' ' 74' ' ' THR . 0.6 OUTLIER -129.69 157.71 41.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.808 179.938 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.489 ' HB ' ' HG3' ' A' ' 64' ' ' GLU . 75.7 t -63.67 -20.57 26.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.136 179.941 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -91.18 31.0 5.91 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.461 179.933 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -148.9 148.44 29.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.882 0.372 . . . . 0.0 111.114 179.971 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.776 HG22 HG23 ' A' ' 93' ' ' THR . 80.6 p -125.39 169.61 12.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.026 179.974 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.478 ' OH ' HG21 ' A' ' 102' ' ' ILE . 11.0 p90 -174.29 134.92 0.43 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.936 179.96 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.419 ' HG3' ' HA ' ' A' ' 91' ' ' ASP . 11.6 mp0 -87.82 165.39 15.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.968 -179.996 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 83' ' ' ARG . . . . . 0.512 ' NE ' ' HD2' ' A' ' 84' ' ' PRO . 0.0 OUTLIER -148.3 113.13 3.8 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.772 179.966 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.512 ' HD2' ' NE ' ' A' ' 83' ' ' ARG . 37.4 Cg_endo -66.2 74.1 0.36 Allowed 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.699 2.266 . . . . 0.0 112.254 179.986 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.565 ' HE2' ' CE2' ' A' ' 70' ' ' TYR . 4.9 mmtt -100.08 131.06 46.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.871 -179.959 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 9.5 t0 57.23 -173.85 0.08 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.778 179.962 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.456 ' O ' ' HB2' ' A' ' 88' ' ' MET . 8.5 m -72.48 58.58 0.41 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.958 179.967 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.456 ' HB2' ' O ' ' A' ' 87' ' ' SER . 1.9 ttm 176.48 166.93 0.47 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.859 -179.999 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 1.9 mp -123.84 146.18 29.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.108 179.989 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 90' ' ' TRP . . . . . 0.623 ' CD1' ' N ' ' A' ' 90' ' ' TRP . 0.0 OUTLIER -137.09 139.17 41.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.811 -179.941 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.419 ' HA ' ' HG3' ' A' ' 82' ' ' GLU . 6.0 m-20 -77.91 63.36 2.91 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.757 179.889 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 92' ' ' CYS . . . . . 0.444 ' HA ' ' O ' ' A' ' 103' ' ' SER . 3.8 m -44.88 112.52 0.44 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.163 -179.895 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.776 HG23 HG22 ' A' ' 80' ' ' THR . 0.9 OUTLIER -96.48 143.49 27.45 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.78 179.771 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 94' ' ' CYS . . . . . 0.424 ' SG ' ' O ' ' A' ' 76' ' ' ARG . 3.5 t -74.58 81.44 1.99 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.047 -179.822 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.557 HD12 ' HB2' ' A' ' 103' ' ' SER . 2.6 mt -101.51 145.11 12.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.209 179.987 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 116.05 146.43 8.67 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.499 -179.914 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -89.27 45.32 1.28 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.806 0.336 . . . . 0.0 111.154 -179.91 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.405 ' O ' ' HB2' ' A' ' 99' ' ' ARG . . . 142.05 -9.45 2.5 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.649 179.849 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.518 ' O ' ' N ' ' A' ' 101' ' ' ARG . 0.9 OUTLIER 173.6 -40.84 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.782 0.325 . . . . 0.0 110.936 -179.983 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 0.404 ' C ' ' O ' ' A' ' 99' ' ' ARG . . . 38.16 -91.5 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.384 -179.958 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.518 ' N ' ' O ' ' A' ' 99' ' ' ARG . 0.0 OUTLIER -179.03 33.68 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.748 0.309 . . . . 0.0 110.982 179.758 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.478 HG21 ' OH ' ' A' ' 81' ' ' TYR . 3.2 mt 28.55 89.26 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.671 179.756 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.557 ' HB2' HD12 ' A' ' 95' ' ' ILE . 1.4 t -55.78 148.49 16.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.868 179.941 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.447 ' SG ' ' O ' ' A' ' 103' ' ' SER . 18.5 m -157.17 142.82 17.52 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.973 -179.939 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -162.18 134.61 5.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.069 179.996 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.578 HG13 ' CE3' ' A' ' 90' ' ' TRP . 3.5 mt -51.15 142.12 3.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.086 179.887 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -63.0 170.22 2.87 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.126 179.929 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -96.87 95.19 7.69 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.945 179.999 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.247 -0.883 . . . . 0.0 110.924 179.969 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 50.3 m . . . . . 0 N--CA 1.487 1.384 0 CA-C-O 120.8 0.333 . . . . 0.0 111.081 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.7 pttp -176.24 96.35 0.25 Allowed Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.987 -179.885 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -80.04 167.54 19.87 Favored 'Trans proline' 0 N--CA 1.464 -0.237 0 C-N-CA 122.841 2.361 . . . . 0.0 112.522 -179.886 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 20' ' ' GLY . . . . . 0.556 ' HA2' HD11 ' A' ' 30' ' ' ILE . . . 79.51 159.8 17.93 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.623 179.791 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.6 m -92.03 174.3 7.39 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.743 0.306 . . . . 0.0 110.921 179.936 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 85.3 t80 177.61 143.98 0.1 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.864 -179.976 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 166.66 169.7 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.87 179.977 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.418 ' CG ' ' O ' ' A' ' 24' ' ' ASN . 35.1 t30 54.09 24.34 4.73 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.902 179.927 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 77.4 6.73 86.76 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.576 179.94 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.585 ' HB3' ' CE1' ' A' ' 28' ' ' TYR . 2.1 ttpt -119.74 149.48 41.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.75 0.309 . . . . 0.0 110.876 -179.985 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 -116.51 96.42 5.51 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.109 -179.834 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.585 ' CE1' ' HB3' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -90.73 171.53 9.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.96 -179.995 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.486 ' O ' ' HB2' ' A' ' 32' ' ' GLN . 0.1 OUTLIER -95.17 173.88 7.34 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.905 179.934 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.676 HD12 ' HA2' ' A' ' 49' ' ' GLY . 33.5 mm -72.45 148.41 9.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.166 -179.989 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 65.6 m-20 64.24 10.73 5.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.852 -179.918 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.486 ' HB2' ' O ' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -88.78 158.31 18.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.784 -179.999 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -119.29 138.59 52.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.956 -179.87 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 34' ' ' TRP . . . . . 0.563 ' CE2' ' HB2' ' A' ' 45' ' ' CYS . 37.2 p90 -149.59 -179.77 7.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.037 -179.904 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.49 ' HG2' ' O ' ' A' ' 43' ' ' LEU . 3.9 tt0 -117.58 128.82 55.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.577 -179.991 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 36' ' ' ARG . . . . . 0.993 ' O ' HD22 ' A' ' 43' ' ' LEU . 2.9 ttt180 -114.82 169.79 8.82 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.811 0.338 . . . . 0.0 110.965 -179.985 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.1 m -130.05 130.48 44.97 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.644 -179.916 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -147.74 143.78 27.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.791 179.85 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.501 HD13 ' HA ' ' A' ' 39' ' ' LEU . 0.5 OUTLIER 51.24 35.28 13.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.681 -179.838 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 66.95 38.8 93.07 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.827 -0.701 . . . . 0.0 112.494 -179.89 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 36.3 m-20 -134.87 179.77 6.1 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 120.856 0.36 . . . . 0.0 110.934 -179.93 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.886 ' C ' HD13 ' A' ' 43' ' ' LEU . . . -125.67 118.75 26.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.988 179.859 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.993 HD22 ' O ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -124.9 163.67 21.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.961 0.41 . . . . 0.0 111.347 -179.871 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.476 ' HA ' ' HA ' ' A' ' 35' ' ' GLU . 2.4 t -111.97 125.06 69.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.092 179.163 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.563 ' HB2' ' CE2' ' A' ' 34' ' ' TRP . 89.0 m -103.66 163.75 12.11 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.789 -178.874 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.445 ' O ' ' HA ' ' A' ' 54' ' ' PHE . 21.1 m -146.13 119.28 8.85 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.601 179.708 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.539 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 13.4 t -79.06 154.94 29.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.128 -179.61 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.423 ' C ' HG23 ' A' ' 30' ' ' ILE . 15.4 m-85 -123.49 -47.66 1.97 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.851 179.908 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.676 ' HA2' HD12 ' A' ' 30' ' ' ILE . . . 119.22 139.21 5.95 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.418 -179.888 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 78.04 -111.3 3.22 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.747 179.874 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -117.86 -4.14 11.14 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.721 0.296 . . . . 0.0 111.152 -179.81 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 6.5 mtt180 -55.57 -26.14 41.9 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.985 -179.896 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 69.01 -173.65 34.83 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.536 179.908 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.579 ' CD1' ' O ' ' A' ' 54' ' ' PHE . 29.5 p90 -129.68 122.65 29.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.893 0.378 . . . . 0.0 111.007 -179.952 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -91.2 147.73 22.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.489 179.795 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.471 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.8 OUTLIER -137.35 156.51 48.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.926 0.393 . . . . 0.0 111.181 -179.834 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -144.59 133.56 22.63 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.797 179.923 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 22.9 t -37.43 130.52 0.95 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.057 179.972 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -39.09 118.68 1.15 Allowed Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.87 179.899 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_exo -51.45 152.74 11.49 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.685 2.257 . . . . 0.0 112.232 179.929 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -50.54 -54.13 24.88 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.088 -179.94 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -111.21 122.76 48.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.135 -179.943 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.619 ' HG3' ' HB1' ' A' ' 97' ' ' ALA . 1.2 tt0 -113.91 -43.69 3.24 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.505 179.977 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.483 ' O ' HG23 ' A' ' 65' ' ' THR . 12.1 mt-10 -64.34 82.57 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.899 -179.77 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.483 HG23 ' O ' ' A' ' 64' ' ' GLU . 0.0 OUTLIER -177.24 166.32 2.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.192 179.899 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.467 ' O ' HG23 ' A' ' 74' ' ' THR . 0.8 OUTLIER -158.9 178.76 9.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.9 -179.817 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.437 ' O ' ' N ' ' A' ' 69' ' ' LYS . 44.8 t80 -131.49 85.04 2.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.883 179.985 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 68' ' ' ASP . . . . . 0.51 ' O ' ' N ' ' A' ' 72' ' ' GLY . 10.1 p-10 -53.65 86.83 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.964 179.994 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 69' ' ' LYS . . . . . 0.437 ' N ' ' O ' ' A' ' 67' ' ' PHE . 0.1 OUTLIER -40.32 -46.95 2.43 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.914 179.933 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.411 ' C ' ' O ' ' A' ' 69' ' ' LYS . 8.7 m-30 -36.59 -74.94 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.954 179.928 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -93.79 -41.38 9.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.019 -179.976 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 72' ' ' GLY . . . . . 0.51 ' N ' ' O ' ' A' ' 68' ' ' ASP . . . 108.02 -3.44 33.61 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.661 -0.781 . . . . 0.0 112.468 -179.994 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 73' ' ' ASN . . . . . 0.492 ' OD1' ' N ' ' A' ' 73' ' ' ASN . 0.3 OUTLIER -73.21 102.57 3.67 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.836 0.351 . . . . 0.0 110.848 -179.982 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.467 HG23 ' O ' ' A' ' 66' ' ' CYS . 93.1 m -41.69 134.39 2.48 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.081 179.941 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 75' ' ' TYR . . . . . 0.421 ' HB2' ' SG ' ' A' ' 66' ' ' CYS . 14.3 m-85 -122.76 -174.26 2.88 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.739 179.959 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -117.7 149.46 40.7 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.804 179.94 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.452 ' CG1' ' HG2' ' A' ' 64' ' ' GLU . 9.6 p -63.08 -28.73 45.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.085 -179.991 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -91.69 11.13 72.99 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.518 179.872 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -126.07 153.9 43.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.836 0.351 . . . . 0.0 110.897 179.99 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.577 ' HB ' HG23 ' A' ' 93' ' ' THR . 0.1 OUTLIER -127.07 167.68 15.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.152 -179.883 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.485 ' OH ' HG21 ' A' ' 102' ' ' ILE . 0.5 OUTLIER -149.56 154.1 38.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.885 -179.98 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -102.4 164.59 11.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.941 179.959 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 169.95 121.96 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.769 -179.998 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 84' ' ' PRO . . . . . 0.454 ' HA ' ' HA ' ' A' ' 89' ' ' ILE . 45.4 Cg_endo -68.45 161.49 44.7 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.73 2.287 . . . . 0.0 112.421 -179.962 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.432 ' O ' ' NE1' ' A' ' 90' ' ' TRP . 11.4 tptt 173.86 161.98 0.17 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.897 179.973 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 86' ' ' ASP . . . . . 0.489 ' O ' ' CB ' ' A' ' 87' ' ' SER . 1.1 m-20 56.81 19.97 4.84 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.934 -179.98 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.489 ' CB ' ' O ' ' A' ' 86' ' ' ASP . 1.4 t 82.16 18.61 0.35 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.876 -179.993 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 88' ' ' MET . . . . . 0.621 ' SD ' HD11 ' A' ' 106' ' ' ILE . 5.6 ttm -162.2 172.68 15.39 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.958 -179.941 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 89' ' ' ILE . . . . . 0.507 ' C ' ' CD1' ' A' ' 90' ' ' TRP . 2.8 mt -96.75 141.85 14.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.054 179.912 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 90' ' ' TRP . . . . . 0.584 ' CE3' ' HB ' ' A' ' 106' ' ' ILE . 0.5 OUTLIER -142.89 84.61 1.85 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.84 -179.985 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -38.88 92.23 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.715 -179.935 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 92' ' ' CYS . . . . . 0.505 ' N ' ' O ' ' A' ' 90' ' ' TRP . 0.1 OUTLIER -81.73 129.29 34.67 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.013 -179.955 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.577 HG23 ' HB ' ' A' ' 80' ' ' THR . 63.3 m -114.8 135.66 53.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.086 179.905 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 6.7 t -59.6 88.67 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.097 -179.91 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.479 HG13 ' O ' ' A' ' 93' ' ' THR . 1.3 mt -109.34 87.93 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.282 -179.874 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -176.76 -39.71 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.848 -0.692 . . . . 0.0 112.515 179.942 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 97' ' ' ALA . . . . . 0.619 ' HB1' ' HG3' ' A' ' 63' ' ' GLU . . . 62.68 35.04 14.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.842 0.353 . . . . 0.0 111.205 179.932 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 98' ' ' GLY . . . . . 0.442 ' O ' ' HD3' ' A' ' 99' ' ' ARG . . . 140.42 -10.52 2.97 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.59 -0.814 . . . . 0.0 112.677 179.952 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.442 ' HD3' ' O ' ' A' ' 98' ' ' GLY . 0.2 OUTLIER 176.49 -83.29 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.805 0.336 . . . . 0.0 110.793 -179.899 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 0.469 ' O ' ' HB3' ' A' ' 101' ' ' ARG . . . 35.54 -108.32 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.546 179.965 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.564 ' N ' ' CD ' ' A' ' 101' ' ' ARG . 0.0 OUTLIER 176.95 104.59 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.841 0.353 . . . . 0.0 110.92 179.983 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.485 HG21 ' OH ' ' A' ' 81' ' ' TYR . 2.7 mp -52.2 116.42 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.222 179.986 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 103' ' ' SER . . . . . 0.473 ' O ' ' HA ' ' A' ' 92' ' ' CYS . 3.8 t -82.26 139.74 34.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.771 179.911 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 104' ' ' CYS . . . . . 0.403 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 0.5 OUTLIER -114.91 113.41 24.14 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.997 -179.875 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 1.4 p -97.02 109.4 22.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.048 179.809 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.96 HD13 ' N ' ' A' ' 107' ' ' ALA . 0.0 OUTLIER -58.53 150.29 4.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.338 -179.927 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 107' ' ' ALA . . . . . 0.96 ' N ' HD13 ' A' ' 106' ' ' ILE . . . -99.98 126.84 46.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.946 179.822 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 -109.22 -13.25 14.68 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.036 -179.901 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.214 -0.898 . . . . 0.0 110.794 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo . . . . . 0 C--O 1.231 0.15 0 CA-C-O 120.868 0.278 . . . . 0.0 112.432 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 119.11 177.17 16.48 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.513 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -143.1 107.19 4.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.821 0.343 . . . . 0.0 111.046 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -96.37 118.16 32.34 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.691 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.4 ' OD2' ' CD ' ' A' ' 36' ' ' ARG . 0.2 OUTLIER -149.52 149.69 31.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.963 -179.944 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 39.8 t30 47.14 30.12 1.3 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.95 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 71.36 16.87 75.7 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.546 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.459 ' HB3' ' CZ ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -115.14 155.74 26.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.821 0.343 . . . . 0.0 110.823 -179.991 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 18.6 t-80 -111.38 83.97 1.86 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.151 -179.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.459 ' CZ ' ' HB3' ' A' ' 26' ' ' LYS . 0.9 OUTLIER -82.6 173.68 11.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.784 179.746 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.524 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 1.0 OUTLIER -109.74 140.92 43.07 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.596 179.709 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.66 HD12 ' H ' ' A' ' 30' ' ' ILE . 4.0 mp -36.47 151.62 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.207 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.452 ' HB2' ' O ' ' A' ' 30' ' ' ILE . 29.7 m-80 66.53 13.22 9.19 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.789 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.524 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 13.4 tt0 -100.46 149.16 23.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.844 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.46 ' HG2' ' OG1' ' A' ' 46' ' ' THR . 10.9 mt-30 -115.99 143.93 44.77 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.178 -179.715 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . 0.589 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 37.6 p90 -145.69 162.43 37.57 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.6 179.616 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -100.0 128.19 46.11 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.979 0.419 . . . . 0.0 111.439 -179.519 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.4 ' CD ' ' OD2' ' A' ' 23' ' ' ASP . 0.0 OUTLIER -132.2 -163.26 1.31 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.278 179.527 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.46 ' HA ' ' O ' ' A' ' 41' ' ' ASN . 1.2 t -147.46 134.73 20.6 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.822 0.344 . . . . 0.0 111.244 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.945 ' HB2' HD22 ' A' ' 43' ' ' LEU . 0.3 OUTLIER -90.02 89.67 7.8 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.486 179.71 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.499 ' CB ' ' O ' ' A' ' 38' ' ' TYR . 1.4 tp 82.89 -48.42 0.16 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.721 -179.729 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . 0.436 ' O ' ' ND2' ' A' ' 41' ' ' ASN . . . 178.53 34.9 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.867 -0.683 . . . . 0.0 112.557 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.46 ' O ' ' HA ' ' A' ' 37' ' ' THR . 25.1 m120 -148.18 148.59 30.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.659 0.266 . . . . 0.0 110.934 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.434 ' C ' ' O ' ' A' ' 41' ' ' ASN . . . -36.53 141.96 0.1 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.695 179.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.945 HD22 ' HB2' ' A' ' 38' ' ' TYR . 21.9 tp -169.92 99.38 0.3 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.85 0.357 . . . . 0.0 111.27 -179.567 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.509 ' N ' ' O ' ' A' ' 57' ' ' GLU . 24.8 t -75.92 159.53 5.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.569 179.492 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.589 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 0.0 OUTLIER -140.77 144.91 35.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.856 0.36 . . . . 0.0 111.266 -179.769 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.46 ' OG1' ' HG2' ' A' ' 33' ' ' GLN . 86.1 m -129.66 123.48 31.31 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.915 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.477 ' SG ' ' HA ' ' A' ' 30' ' ' ILE . 30.3 t -80.63 137.61 36.36 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.002 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.437 ' CE1' ' O ' ' A' ' 46' ' ' THR . 5.5 m-85 -117.05 -2.27 11.75 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.975 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.561 ' N ' HG23 ' A' ' 30' ' ' ILE . . . 135.02 -173.62 21.51 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.438 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -85.13 -11.12 76.79 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.485 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -109.49 -44.32 3.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.819 0.342 . . . . 0.0 110.954 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 3.9 mtt180 -73.38 -29.39 62.59 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.049 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 75.26 -156.45 48.68 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.549 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.534 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 12.1 p90 -134.07 150.0 51.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.889 0.376 . . . . 0.0 110.952 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -120.46 104.39 9.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.839 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.478 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 1.2 m -67.48 163.78 20.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.936 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.632 ' C ' HD12 ' A' ' 43' ' ' LEU . 0.2 OUTLIER -166.6 142.34 4.53 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.862 179.889 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.48 ' N ' HD12 ' A' ' 43' ' ' LEU . 3.4 m -69.38 146.49 52.05 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.879 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.426 ' C ' ' O ' ' A' ' 58' ' ' SER . 0.9 OUTLIER . . . . . 0 C--N 1.329 -0.289 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.871 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.509 ' O ' ' CB ' ' A' ' 64' ' ' GLU . 3.0 tt0 . . . . . 0 N--CA 1.455 -0.183 0 CA-C-O 120.729 0.3 . . . . 0.0 110.572 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.664 ' O ' HG23 ' A' ' 65' ' ' THR . 3.6 mt-10 159.37 63.05 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.078 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.664 HG23 ' O ' ' A' ' 64' ' ' GLU . 0.1 OUTLIER 170.66 154.54 0.06 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.13 179.958 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 17.8 m -126.07 -154.55 0.63 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.835 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.406 ' O ' ' N ' ' A' ' 73' ' ' ASN . 44.6 t80 -158.3 -40.31 0.06 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.024 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . 0.515 ' O ' ' N ' ' A' ' 72' ' ' GLY . 3.7 t0 71.01 70.07 0.18 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.968 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -43.05 -29.41 0.35 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.915 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . 0.584 ' CE2' ' HE3' ' A' ' 85' ' ' LYS . 7.5 m-30 -53.28 -54.18 40.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.947 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 25.4 m -119.97 -36.5 3.26 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.072 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . 0.515 ' N ' ' O ' ' A' ' 68' ' ' ASP . . . 97.79 47.71 2.06 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.439 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . 0.491 ' HB3' ' CZ ' ' A' ' 75' ' ' TYR . 0.4 OUTLIER -96.77 -172.56 2.5 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.787 0.327 . . . . 0.0 110.844 -179.979 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.491 ' O ' ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -120.78 117.99 28.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.016 179.913 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.491 ' CZ ' ' HB3' ' A' ' 73' ' ' ASN . 9.6 m-85 -136.87 144.75 43.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.906 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -83.53 165.19 19.31 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.961 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 13.5 p -81.11 -18.46 11.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.169 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -100.92 42.96 1.82 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.509 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -164.21 133.1 3.7 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.813 0.34 . . . . 0.0 110.964 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 58.2 p -93.6 163.72 13.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.187 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 33.2 p90 -160.65 110.7 1.75 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.856 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -55.5 160.5 2.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.021 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.422 ' HA ' ' HD2' ' A' ' 84' ' ' PRO . 0.0 OUTLIER -148.91 96.59 3.75 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.8 179.888 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.422 ' HD2' ' HA ' ' A' ' 83' ' ' ARG . 36.8 Cg_endo -65.79 114.91 3.14 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.769 2.312 . . . . 0.0 112.333 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.584 ' HE3' ' CE2' ' A' ' 70' ' ' TYR . 0.5 OUTLIER -141.67 111.14 6.46 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.839 -179.978 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.454 ' CB ' ' O ' ' A' ' 85' ' ' LYS . 0.9 OUTLIER 80.65 -159.16 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.768 -179.963 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . 0.445 ' O ' ' OG ' ' A' ' 87' ' ' SER . 2.3 t -89.85 17.32 6.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.919 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . 0.581 ' HG2' ' CZ2' ' A' ' 90' ' ' TRP . 16.5 tpp -131.61 129.74 41.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.829 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -92.03 139.29 18.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.177 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' TRP . . . . . 0.581 ' CZ2' ' HG2' ' A' ' 88' ' ' MET . 1.7 m95 -136.4 152.21 50.37 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.823 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -104.89 87.65 2.71 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.842 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 73.2 m -67.26 140.71 57.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.013 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.569 HG22 HG12 ' A' ' 95' ' ' ILE . 86.6 m -123.94 122.53 38.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.127 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.448 ' SG ' ' HB2' ' A' ' 75' ' ' TYR . 0.0 OUTLIER -63.08 69.65 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.798 -179.993 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.569 HG12 HG22 ' A' ' 93' ' ' THR . 1.2 mt -89.64 46.89 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.353 -179.845 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.454 ' HA2' ' HA2' ' A' ' 100' ' ' GLY . . . -52.4 -81.59 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.484 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.409 ' HA ' ' HG3' ' A' ' 63' ' ' GLU . . . 61.38 -89.05 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.811 0.338 . . . . 0.0 111.098 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -71.11 -30.59 67.39 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.488 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 9.1 ttt180 -174.87 -67.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.846 0.355 . . . . 0.0 110.923 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 0.454 ' HA2' ' HA2' ' A' ' 96' ' ' GLY . . . -167.84 91.05 0.1 OUTLIER Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.486 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 4.5 ttt85 -109.25 42.28 1.48 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.808 0.337 . . . . 0.0 110.971 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.403 ' HA ' ' O ' ' A' ' 93' ' ' THR . 1.2 mp -52.55 95.9 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.193 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 47.5 t -86.48 123.53 31.8 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.913 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 46.2 m -116.02 101.03 8.38 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.844 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 14.0 t -110.98 142.14 43.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.133 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.579 ' H ' HD12 ' A' ' 106' ' ' ILE . 4.6 mp -44.26 149.05 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.987 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -49.09 139.9 10.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.881 0.372 . . . . 0.0 111.104 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -68.23 -33.28 74.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.897 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.228 -0.891 . . . . 0.0 110.938 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.415 ' HB2' HD11 ' A' ' 30' ' ' ILE . 45.0 Cg_exo . . . . . 0 C--O 1.231 0.137 0 CA-C-O 120.814 0.256 . . . . 0.0 112.262 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.37 162.82 3.28 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.665 -0.779 . . . . 0.0 112.474 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 25.0 m -127.4 106.85 9.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.87 0.367 . . . . 0.0 110.846 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 32.6 t80 -86.25 120.87 28.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.985 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.452 ' OD1' ' CB ' ' A' ' 26' ' ' LYS . 3.6 p-10 -97.42 -160.29 0.79 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.866 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.429 ' C ' ' O ' ' A' ' 23' ' ' ASP . 0.4 OUTLIER -34.96 -75.67 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.976 -0.557 . . . . 0.0 111.008 -179.983 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -133.64 33.78 2.51 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.632 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.517 ' HB3' ' CE2' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -140.16 141.17 36.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.836 0.351 . . . . 0.0 110.969 -179.997 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 10.4 t-160 -120.44 90.14 3.27 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.968 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.625 ' CE2' ' CB ' ' A' ' 34' ' ' TRP . 93.1 m-85 -87.26 161.64 17.88 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.094 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.532 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 3.6 tt0 -87.56 156.38 19.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.803 179.829 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.705 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.9 mp -44.45 147.73 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.437 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 24.0 m-80 65.03 13.43 8.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.162 179.704 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.532 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 1.0 OUTLIER -99.74 148.6 24.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.879 0.371 . . . . 0.0 110.781 179.851 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -115.96 151.0 36.25 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.913 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . 0.625 ' CB ' ' CE2' ' A' ' 28' ' ' TYR . 42.6 p90 -152.65 -174.45 4.92 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.902 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -114.61 132.45 56.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.019 -179.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.529 ' O ' ' CB ' ' A' ' 43' ' ' LEU . 3.1 ttt180 -139.22 165.92 25.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.725 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.401 ' OG1' ' C ' ' A' ' 41' ' ' ASN . 2.2 t -136.92 135.9 38.15 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.917 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.797 ' CE1' HD13 ' A' ' 39' ' ' LEU . 1.1 t80 -118.37 125.32 49.76 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.773 179.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.797 HD13 ' CE1' ' A' ' 38' ' ' TYR . 0.8 OUTLIER 65.36 14.42 9.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.605 -179.737 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 87.45 44.61 5.51 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.58 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.427 ' O ' ' C ' ' A' ' 42' ' ' ALA . 27.2 m-80 -144.09 125.5 14.8 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.751 0.31 . . . . 0.0 110.89 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.459 ' O ' ' CD1' ' A' ' 43' ' ' LEU . . . -35.04 147.57 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.945 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.529 ' CB ' ' O ' ' A' ' 36' ' ' ARG . 1.5 tp -165.49 157.78 15.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.988 0.423 . . . . 0.0 111.297 -179.686 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.479 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 3.6 t -126.2 135.46 63.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.335 179.382 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.593 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 0.5 OUTLIER -118.79 162.45 18.45 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.428 -179.486 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 20.5 m -147.69 131.14 16.68 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.895 179.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.501 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 14.3 t -91.35 132.26 36.3 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.882 0.372 . . . . 0.0 111.052 -179.85 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.499 ' HB2' ' HB3' ' A' ' 52' ' ' ARG . 2.0 m-85 -105.17 -35.96 7.42 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.783 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.515 ' HA3' ' CG2' ' A' ' 30' ' ' ILE . . . 76.63 173.08 36.63 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.489 -179.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . 0.52 ' O ' ' CB ' ' A' ' 51' ' ' SER . . . 66.91 18.0 68.15 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.64 -0.79 . . . . 0.0 112.532 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . 0.52 ' CB ' ' O ' ' A' ' 50' ' ' GLY . 1.0 OUTLIER 85.78 -0.56 0.73 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.671 0.272 . . . . 0.0 111.208 179.964 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.499 ' HB3' ' HB2' ' A' ' 48' ' ' TYR . 0.0 OUTLIER -56.87 -27.91 61.07 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.937 0.399 . . . . 0.0 110.882 179.942 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 74.45 129.5 0.19 Allowed Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.67 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.559 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 10.3 p90 -63.97 177.63 0.75 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.843 0.354 . . . . 0.0 110.825 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.515 ' ND2' ' O ' ' A' ' 54' ' ' PHE . 29.4 m120 -152.01 123.92 8.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.929 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.479 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.8 OUTLIER -104.56 155.88 18.45 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.908 179.951 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -170.5 171.75 6.31 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.019 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.432 ' HA ' HD12 ' A' ' 43' ' ' LEU . 0.1 OUTLIER -57.28 136.44 56.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.932 -179.975 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 2.3 tppp? . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.054 179.963 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.455 -0.202 0 CA-C-O 120.781 0.324 . . . . 0.0 110.499 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.508 ' HG3' ' CG2' ' A' ' 77' ' ' VAL . 23.2 tt0 -95.85 57.03 1.78 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.904 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.46 HG23 ' O ' ' A' ' 64' ' ' GLU . 22.4 p -157.06 -174.97 5.17 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.194 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -144.7 -165.19 2.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.844 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 86.9 t80 -163.83 97.94 0.86 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.819 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . 0.486 ' O ' ' N ' ' A' ' 72' ' ' GLY . 3.9 m-20 -72.26 83.57 1.04 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.962 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -39.41 -30.25 0.06 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.882 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 39.0 m-85 -57.45 -61.69 2.31 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.948 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 24.9 p -112.09 19.51 17.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.105 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . 0.486 ' N ' ' O ' ' A' ' 68' ' ' ASP . . . 38.69 54.96 2.24 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.547 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -124.22 160.19 28.46 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.835 0.35 . . . . 0.0 110.702 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.52 155.81 17.64 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.19 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 25.5 m-85 -139.09 -172.09 3.25 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.836 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -104.83 155.75 18.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.939 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.528 HG13 ' O ' ' A' ' 94' ' ' CYS . 2.5 t -90.63 25.73 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.071 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -138.44 17.85 3.29 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.62 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -142.04 136.71 30.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.819 0.342 . . . . 0.0 110.974 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.455 HG22 HG23 ' A' ' 93' ' ' THR . 1.4 p -93.67 114.08 26.3 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.116 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . 0.571 ' OH ' HD13 ' A' ' 102' ' ' ILE . 42.5 p90 -102.93 136.47 42.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.883 -179.935 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 90.1 mt-10 -97.37 164.73 12.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.72 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.79 117.68 1.93 Allowed Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.912 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -70.86 103.42 1.34 Allowed 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.671 2.247 . . . . 0.0 112.299 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -134.28 161.65 34.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.986 -179.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 51.4 31.08 6.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.932 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 71.34 5.36 5.41 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.087 179.934 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -132.62 178.57 6.74 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.924 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.503 ' C ' ' CD1' ' A' ' 90' ' ' TRP . 1.1 mt -116.67 145.33 22.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.076 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' TRP . . . . . 0.631 ' CZ3' ' CD1' ' A' ' 106' ' ' ILE . 0.0 OUTLIER -144.65 128.56 17.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.908 179.972 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.473 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 3.9 p30 -66.88 95.07 0.35 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.744 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . 0.505 ' O ' ' CD1' ' A' ' 81' ' ' TYR . 64.5 m -79.21 96.17 5.83 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.805 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.455 HG23 HG22 ' A' ' 80' ' ' THR . 2.6 m -74.83 148.45 40.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.017 179.934 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.797 ' HA ' HG22 ' A' ' 102' ' ' ILE . 0.1 OUTLIER -96.8 51.01 1.13 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.916 -179.923 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 1.8 mt -44.85 -40.56 2.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.104 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.668 ' O ' ' HB3' ' A' ' 97' ' ' ALA . . . 44.37 -163.08 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.502 179.925 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.668 ' HB3' ' O ' ' A' ' 96' ' ' GLY . . . 83.7 94.84 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.798 0.332 . . . . 0.0 111.075 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 117.67 -62.3 0.42 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.493 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.67 34.59 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.797 0.332 . . . . 0.0 110.88 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 0.449 ' HA2' ' HA2' ' A' ' 96' ' ' GLY . . . 55.16 79.68 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.556 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.518 ' O ' ' CG ' ' A' ' 101' ' ' ARG . 1.4 tmt_? -106.9 56.77 0.64 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.843 0.354 . . . . 0.0 110.862 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.797 HG22 ' HA ' ' A' ' 94' ' ' CYS . 0.8 OUTLIER -50.3 139.74 4.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.288 -179.922 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 12.1 t -115.84 129.69 56.53 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.745 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.471 ' HB3' ' HB2' ' A' ' 90' ' ' TRP . 8.9 m -118.58 143.38 46.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.002 -179.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . 0.474 ' O ' ' HA ' ' A' ' 90' ' ' TRP . 0.3 OUTLIER -151.65 153.77 35.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.039 179.913 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.631 ' CD1' ' CZ3' ' A' ' 90' ' ' TRP . 2.8 mp -59.71 156.6 2.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.311 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.477 ' N ' HG22 ' A' ' 106' ' ' ILE . . . 46.51 -178.57 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.292 179.856 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -97.58 40.78 1.14 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.847 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.102 0 CA-C-O 118.299 -0.858 . . . . 0.0 110.91 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.702 ' HB2' HD11 ' A' ' 30' ' ' ILE . 41.6 Cg_endo . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.794 0.248 . . . . 0.0 112.348 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 154.5 -163.13 31.04 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.684 -0.769 . . . . 0.0 112.536 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 80.4 m -139.39 72.65 1.41 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.818 0.342 . . . . 0.0 110.893 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 30.8 t80 -52.5 117.96 3.25 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.815 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -164.86 150.26 9.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.885 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.435 ' CG ' ' O ' ' A' ' 24' ' ' ASN . 28.1 t-20 62.25 26.66 15.98 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.904 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 72.2 11.31 75.23 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.592 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.585 ' HB3' ' CE1' ' A' ' 28' ' ' TYR . 0.4 OUTLIER -122.12 151.59 40.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.814 0.34 . . . . 0.0 110.863 -179.923 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 5.1 t-160 -111.92 89.98 3.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.085 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.585 ' CE1' ' HB3' ' A' ' 26' ' ' LYS . 3.5 m-85 -79.62 171.02 15.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.028 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.529 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 0.9 OUTLIER -111.92 139.26 47.56 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.82 179.915 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.702 HD11 ' HB2' ' A' ' 19' ' ' PRO . 3.9 mp -35.0 140.38 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.534 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 13.5 m-20 72.62 8.75 5.65 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.15 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.529 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 56.1 tt0 -97.82 155.24 17.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.849 0.357 . . . . 0.0 111.057 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.623 ' CG ' HG23 ' A' ' 46' ' ' THR . 28.5 mt-30 -118.05 156.99 27.64 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.867 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . 0.588 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 38.2 p90 -155.35 166.95 31.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.707 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -99.77 123.13 43.72 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.169 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.62 -163.91 0.92 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.609 179.754 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.585 HG23 ' O ' ' A' ' 37' ' ' THR . 3.4 t -167.08 32.37 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.353 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.732 ' HB2' HD22 ' A' ' 43' ' ' LEU . 0.2 OUTLIER -40.33 143.87 0.27 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.847 179.905 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.463 ' HB2' ' O ' ' A' ' 38' ' ' TYR . 2.3 mm? 66.5 16.5 10.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.857 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 66.95 42.07 92.94 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.524 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.464 ' O ' ' HA ' ' A' ' 37' ' ' THR . 51.6 m-80 -152.23 132.11 13.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.596 0.236 . . . . 0.0 110.781 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.772 ' O ' HD12 ' A' ' 43' ' ' LEU . . . -31.01 135.1 0.06 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.458 -179.761 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.93 HD23 ' HB3' ' A' ' 56' ' ' CYS . 0.7 OUTLIER -153.86 174.66 14.3 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.13 -179.732 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.503 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.6 t -144.88 127.05 9.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.478 179.541 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.588 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 0.8 OUTLIER -117.72 163.41 16.52 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.383 -179.528 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.623 HG23 ' CG ' ' A' ' 33' ' ' GLN . 2.0 m -145.13 134.81 23.42 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.926 179.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.57 ' N ' ' CH2' ' A' ' 34' ' ' TRP . 14.0 t -82.58 135.13 35.15 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.928 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.47 ' C ' HG23 ' A' ' 30' ' ' ILE . 2.2 m-85 -110.62 -32.35 6.92 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.881 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 92.03 -166.95 30.16 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.519 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 42.0 -114.73 0.73 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.751 -0.737 . . . . 0.0 112.631 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -126.07 1.63 7.22 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.659 0.266 . . . . 0.0 111.208 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.508 ' NE ' ' HA ' ' A' ' 52' ' ' ARG . 0.1 OUTLIER -59.25 -38.39 79.95 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.785 0.326 . . . . 0.0 110.98 -179.923 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 70.59 141.34 0.19 Allowed Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.631 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.574 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 7.7 p90 -59.7 172.97 0.62 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.848 0.356 . . . . 0.0 110.807 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -156.06 108.35 2.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.762 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.93 ' HB3' HD23 ' A' ' 43' ' ' LEU . 2.1 m -75.5 172.18 12.98 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.032 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -141.28 -94.06 0.14 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.125 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.9 t 178.86 131.33 0.08 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.874 0.369 . . . . 0.0 110.917 -179.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.595 ' CB ' ' HB1' ' A' ' 42' ' ' ALA . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.792 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 . . . . . 0 N--CA 1.455 -0.18 0 CA-C-O 120.777 0.322 . . . . 0.0 110.57 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 72.77 -172.65 0.14 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.947 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.447 ' HA ' ' O ' ' A' ' 75' ' ' TYR . 24.4 p 48.83 -167.03 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.02 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.625 ' O ' HG23 ' A' ' 74' ' ' THR . 5.7 p 167.23 177.8 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.962 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 38.3 t80 -129.36 111.53 12.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.906 179.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -79.38 94.13 5.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.926 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.434 ' HB3' ' CE1' ' A' ' 70' ' ' TYR . 0.1 OUTLIER -51.87 173.91 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.749 179.925 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . 0.481 ' CD1' ' N ' ' A' ' 70' ' ' TYR . 0.8 OUTLIER 76.19 -54.58 0.6 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.815 -179.961 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -107.22 -17.57 14.12 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.108 179.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 54.07 72.72 0.5 Allowed Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.48 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -140.83 96.27 2.99 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.789 0.328 . . . . 0.0 110.838 -179.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.625 HG23 ' O ' ' A' ' 66' ' ' CYS . 85.0 m -50.74 135.99 22.69 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.033 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.447 ' O ' ' HA ' ' A' ' 65' ' ' THR . 21.9 m-85 -129.47 175.3 8.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.893 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.09 133.84 41.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.826 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.402 ' HA ' ' O ' ' A' ' 94' ' ' CYS . 7.1 p -46.4 -39.77 3.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.029 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -94.99 33.14 5.57 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.472 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -135.13 114.67 12.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.882 0.373 . . . . 0.0 110.955 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.608 HG22 HG23 ' A' ' 93' ' ' THR . 44.9 p -86.36 150.31 24.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.163 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . 0.524 ' CE1' ' HB3' ' A' ' 92' ' ' CYS . 32.9 p90 -139.4 -178.6 5.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.808 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.412 ' OE2' ' OD1' ' A' ' 108' ' ' ASN . 1.9 mp0 -115.97 151.38 35.54 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.888 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 14.7 ttm180 -139.31 101.03 7.59 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.96 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -75.34 113.71 3.83 Favored 'Trans proline' 0 N--CA 1.464 -0.264 0 C-N-CA 122.798 2.332 . . . . 0.0 112.364 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.7 mtpp -157.34 161.95 39.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.924 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 50.06 25.5 1.73 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.871 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.2 t 72.98 8.11 5.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.041 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . 0.447 ' O ' ' NE1' ' A' ' 90' ' ' TRP . 0.0 OUTLIER -138.57 134.02 33.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.955 179.991 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.54 ' C ' ' CD1' ' A' ' 90' ' ' TRP . 2.8 mp -85.3 157.97 3.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.058 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' TRP . . . . . 0.55 ' CH2' HD11 ' A' ' 106' ' ' ILE . 4.5 m95 -148.89 107.95 3.89 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.95 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.507 ' N ' ' O ' ' A' ' 105' ' ' THR . 11.1 t70 -58.58 91.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.785 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . 0.524 ' HB3' ' CE1' ' A' ' 81' ' ' TYR . 0.8 OUTLIER -74.46 150.49 39.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.134 -179.939 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.608 HG23 HG22 ' A' ' 80' ' ' THR . 41.7 m -127.49 108.1 10.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.993 179.875 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.402 ' O ' ' HA ' ' A' ' 77' ' ' VAL . 20.3 t -53.85 82.35 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.948 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.52 ' N ' ' O ' ' A' ' 93' ' ' THR . 1.5 mt -77.89 -26.57 14.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.216 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.45 ' HA3' ' HA3' ' A' ' 100' ' ' GLY . . . -158.42 164.03 33.26 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.514 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.457 ' O ' ' N ' ' A' ' 99' ' ' ARG . . . -91.92 104.14 16.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.781 0.324 . . . . 0.0 111.098 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 36.95 30.7 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.479 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.457 ' N ' ' O ' ' A' ' 97' ' ' ALA . 0.4 OUTLIER -147.98 -46.14 0.16 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.783 0.325 . . . . 0.0 110.935 -179.962 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 0.48 ' C ' ' CG ' ' A' ' 101' ' ' ARG . . . -65.08 -98.07 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.572 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.48 ' CG ' ' C ' ' A' ' 100' ' ' GLY . 0.0 OUTLIER 172.02 94.3 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.751 0.31 . . . . 0.0 110.95 -179.987 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 43.0 mt -72.07 78.15 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.125 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.461 ' O ' ' HA ' ' A' ' 92' ' ' CYS . 1.4 t -54.93 151.06 9.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.078 -179.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.485 ' SG ' ' HB2' ' A' ' 90' ' ' TRP . 0.0 OUTLIER -130.31 150.99 51.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.75 179.924 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . 0.507 ' O ' ' N ' ' A' ' 91' ' ' ASP . 0.2 OUTLIER -167.28 134.2 2.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.916 0.389 . . . . 0.0 111.356 -179.947 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.55 HD11 ' CH2' ' A' ' 90' ' ' TRP . 1.2 mp -66.57 165.25 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.118 179.863 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.509 ' N ' HG22 ' A' ' 106' ' ' ILE . . . 68.61 120.08 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.142 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . 0.412 ' OD1' ' OE2' ' A' ' 82' ' ' GLU . 0.1 OUTLIER -88.73 76.45 8.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.943 -179.979 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 20.0 ttt85 . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.293 -0.861 . . . . 0.0 110.879 179.883 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_exo . . . . . 0 N--CA 1.465 -0.191 0 CA-C-O 120.881 0.284 . . . . 0.0 112.419 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 137.02 163.29 9.68 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.464 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.3 m -112.14 135.19 53.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.826 0.346 . . . . 0.0 110.914 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -115.09 115.68 27.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.85 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -160.21 159.92 32.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.853 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.512 ' ND2' ' O ' ' A' ' 24' ' ' ASN . 12.4 t30 58.8 25.19 13.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.9 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 72.89 7.27 69.83 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.443 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.496 ' HB3' ' CZ ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -122.91 142.3 50.95 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.756 0.312 . . . . 0.0 111.004 179.963 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 2.9 t-160 -114.49 88.28 2.82 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.862 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.496 ' CZ ' ' HB3' ' A' ' 26' ' ' LYS . 0.5 OUTLIER -79.63 -170.28 2.3 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.939 -179.939 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.493 ' O ' ' HB2' ' A' ' 32' ' ' GLN . 0.0 OUTLIER -102.12 173.24 6.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.953 -179.962 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.713 HD12 ' H ' ' A' ' 30' ' ' ILE . 2.9 mp -66.4 155.63 7.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.469 -179.777 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 85.7 m-20 53.78 18.02 1.44 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.202 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.493 ' HB2' ' O ' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -95.29 151.46 19.23 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.668 179.823 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 -115.8 144.77 43.53 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.101 -179.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . 0.549 ' CZ3' ' HB2' ' A' ' 47' ' ' CYS . 41.2 p90 -148.9 178.78 8.38 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.753 179.663 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -103.11 129.87 50.1 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.025 0.441 . . . . 0.0 111.28 -179.715 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.528 ' O ' ' N ' ' A' ' 43' ' ' LEU . 32.5 ttt-85 -132.99 170.66 15.04 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.296 179.558 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.485 ' HA ' ' HB2' ' A' ' 43' ' ' LEU . 1.2 t -139.46 132.78 29.99 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.872 0.368 . . . . 0.0 111.477 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.512 ' CB ' HD22 ' A' ' 43' ' ' LEU . 45.9 t80 -124.05 124.21 42.04 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.655 179.793 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 70.33 22.37 5.39 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.989 0.424 . . . . 0.0 110.478 -179.711 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 76.4 41.06 26.53 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.923 -0.656 . . . . 0.0 112.501 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.441 ' C ' ' HG1' ' A' ' 37' ' ' THR . 69.0 m-80 -145.46 138.08 25.92 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.819 0.342 . . . . 0.0 111.254 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -37.75 152.31 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.876 179.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.528 ' N ' ' O ' ' A' ' 36' ' ' ARG . 2.2 tp -167.28 159.62 12.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.22 -179.839 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.503 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.6 t -130.24 129.11 64.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.661 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.567 ' SG ' ' CD1' ' A' ' 54' ' ' PHE . 0.8 OUTLIER -110.75 163.53 13.68 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.32 -179.715 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 35.4 m -144.78 118.41 9.17 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.031 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.549 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 35.2 t -72.71 145.62 47.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.018 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.517 ' CB ' ' HB3' ' A' ' 52' ' ' ARG . 4.9 m-85 -119.39 -16.3 8.98 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.921 179.939 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.538 ' N ' HG23 ' A' ' 30' ' ' ILE . . . 92.57 179.95 40.5 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.505 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . 0.417 ' C ' ' O ' ' A' ' 49' ' ' GLY . . . 36.13 -107.8 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.482 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 28.4 t -131.67 7.79 4.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.776 0.322 . . . . 0.0 111.05 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.517 ' HB3' ' CB ' ' A' ' 48' ' ' TYR . 7.3 mmt180 -52.66 -19.77 2.61 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.966 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 68.62 151.59 0.38 Allowed Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.355 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.567 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 4.3 p90 -92.96 157.95 16.06 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.834 0.35 . . . . 0.0 110.945 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -116.87 115.6 25.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.623 179.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.503 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.1 OUTLIER -102.93 152.81 20.87 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.203 -179.778 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -175.26 179.49 1.51 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.814 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 26.7 t -73.9 135.14 43.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.925 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.462 ' CD ' HG21 ' A' ' 44' ' ' VAL . 3.9 tptp . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.931 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 . . . . . 0 N--CA 1.456 -0.17 0 CA-C-O 120.928 0.394 . . . . 0.0 110.468 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.01 -176.38 2.07 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.91 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.5 p 64.85 -162.27 0.27 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.198 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.469 ' O ' ' HA ' ' A' ' 74' ' ' THR . 29.0 m -160.19 157.6 28.58 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.857 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.429 ' O ' ' C ' ' A' ' 68' ' ' ASP . 71.2 t80 -110.14 -17.65 13.5 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.67 179.776 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . 0.443 ' OD2' ' CE2' ' A' ' 81' ' ' TYR . 4.3 t0 35.52 93.56 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.027 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.577 ' O ' ' CD2' ' A' ' 70' ' ' TYR . 4.0 ptmt -52.87 -170.13 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.624 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . 0.577 ' CD2' ' O ' ' A' ' 69' ' ' LYS . 8.1 m-85 83.87 -56.4 0.14 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.837 0.351 . . . . 0.0 110.922 -179.829 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -134.45 17.55 3.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.159 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 45.14 58.68 4.92 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.391 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -89.61 164.86 14.57 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.811 0.339 . . . . 0.0 110.894 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.469 ' HA ' ' O ' ' A' ' 66' ' ' CYS . 0.9 OUTLIER -118.29 90.19 3.28 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.134 179.905 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 16.6 m-30 -97.94 -168.85 1.73 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.861 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.94 162.49 30.54 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.763 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 3.4 t -76.58 -22.92 15.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.134 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -92.18 15.04 63.01 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.566 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -151.53 113.73 4.54 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.771 0.319 . . . . 0.0 110.815 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.812 ' HB ' HG23 ' A' ' 93' ' ' THR . 1.3 t -74.18 179.43 4.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.12 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . 0.734 ' OH ' HG21 ' A' ' 102' ' ' ILE . 45.7 p90 -153.71 168.26 26.84 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.931 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -110.64 144.21 39.89 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.706 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.04 96.02 4.35 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.0 -179.888 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_exo -56.22 138.88 84.8 Favored 'Trans proline' 0 N--CA 1.466 -0.134 0 C-N-CA 122.836 2.357 . . . . 0.0 112.044 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.428 ' O ' ' N ' ' A' ' 87' ' ' SER . 0.2 OUTLIER -155.39 165.11 37.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.917 0.389 . . . . 0.0 111.095 -179.932 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 46.76 -92.7 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.024 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . 0.428 ' N ' ' O ' ' A' ' 85' ' ' LYS . 0.8 OUTLIER -152.16 18.37 0.66 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.969 -179.964 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . 0.408 ' CE ' ' HA ' ' A' ' 88' ' ' MET . 0.6 OUTLIER -147.1 167.45 24.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.878 -179.995 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.411 ' O ' ' N ' ' A' ' 107' ' ' ALA . 4.0 mt -107.39 140.34 26.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.063 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' TRP . . . . . 0.533 ' CD1' ' N ' ' A' ' 90' ' ' TRP . 0.7 OUTLIER -131.86 124.5 29.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.953 -179.868 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -67.1 72.08 0.1 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.742 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . 0.48 ' HA ' ' O ' ' A' ' 103' ' ' SER . 54.3 m -59.89 111.83 1.62 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.024 -179.845 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.812 HG23 ' HB ' ' A' ' 80' ' ' THR . 32.2 m -103.79 119.74 39.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.98 179.803 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.818 ' HA ' HD12 ' A' ' 102' ' ' ILE . 0.0 OUTLIER -58.53 80.53 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.832 -179.907 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.467 ' N ' ' O ' ' A' ' 93' ' ' THR . 2.1 mt -98.87 101.05 11.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.312 -179.84 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 144.66 176.19 18.45 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.5 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -69.23 58.82 0.11 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.837 0.351 . . . . 0.0 111.087 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.43 -23.47 15.53 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.559 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -176.58 55.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.846 0.355 . . . . 0.0 110.961 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -89.75 -37.16 6.99 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.39 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.517 ' O ' ' N ' ' A' ' 103' ' ' SER . 2.3 ptp85 -178.58 49.33 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.842 0.353 . . . . 0.0 110.74 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.818 HD12 ' HA ' ' A' ' 94' ' ' CYS . 10.4 mm -38.39 90.48 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.262 -179.903 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.517 ' N ' ' O ' ' A' ' 101' ' ' ARG . 21.9 t -69.08 174.2 4.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.603 179.777 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.451 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 20.1 m -155.76 124.35 5.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.032 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 2.9 p -92.89 104.67 16.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.108 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.507 HG13 ' CZ3' ' A' ' 90' ' ' TRP . 1.3 tt -43.99 151.0 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.083 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.411 ' N ' ' O ' ' A' ' 89' ' ' ILE . . . -121.91 126.25 48.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.063 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 22.1 p30 -147.49 173.14 12.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.888 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.284 -0.865 . . . . 0.0 110.866 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_exo . . . . . 0 N--CA 1.465 -0.158 0 CA-C-O 120.804 0.252 . . . . 0.0 112.303 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.18 -167.82 45.91 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.454 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 54.5 m -126.79 132.42 51.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.842 0.353 . . . . 0.0 110.938 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 11.9 t80 -105.98 123.17 47.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.772 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -156.99 134.25 10.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.057 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.465 ' OD1' ' O ' ' A' ' 24' ' ' ASN . 29.8 t30 63.33 11.09 5.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.132 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 97.49 -13.19 64.5 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.8 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.77 146.44 24.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.784 0.326 . . . . 0.0 110.708 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 9.9 t-160 -118.21 90.89 3.43 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.264 -179.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -80.91 -165.82 0.99 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.822 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.52 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 0.5 OUTLIER -116.59 158.71 23.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.729 179.799 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.681 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.2 mp -51.98 152.54 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.303 -179.791 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.529 ' ND2' HG22 ' A' ' 30' ' ' ILE . 1.6 m-80 55.07 20.49 3.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.162 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.52 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 18.7 tt0 -101.28 152.08 21.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.759 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.421 ' HG2' ' OG1' ' A' ' 46' ' ' THR . 19.9 mt-30 -117.22 145.11 44.11 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.021 -179.836 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . 0.603 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 38.2 p90 -146.89 177.56 9.03 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.736 179.771 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -107.78 133.33 52.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.285 -179.631 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.436 ' NE ' ' O ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -132.78 -168.83 2.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.449 179.569 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.582 ' HG1' ' C ' ' A' ' 41' ' ' ASN . 1.1 t -158.48 145.4 17.57 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.886 0.374 . . . . 0.0 111.283 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.538 ' CE1' HD13 ' A' ' 39' ' ' LEU . 41.0 t80 -132.77 132.28 42.08 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.655 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.538 HD13 ' CE1' ' A' ' 38' ' ' TYR . 0.5 OUTLIER 57.4 22.36 7.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.563 -179.727 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 81.88 42.69 8.74 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.859 -0.686 . . . . 0.0 112.558 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.582 ' C ' ' HG1' ' A' ' 37' ' ' THR . 83.9 m-20 -143.6 130.95 20.92 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 120.802 0.334 . . . . 0.0 111.137 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.522 ' O ' ' CD1' ' A' ' 43' ' ' LEU . . . -39.34 156.64 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.838 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.522 ' CD1' ' O ' ' A' ' 42' ' ' ALA . 1.4 tp -169.32 160.07 9.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.217 -179.905 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.496 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.9 t -127.29 128.77 70.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.625 179.624 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.603 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 0.8 OUTLIER -114.69 151.39 33.71 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.148 -179.719 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.421 ' OG1' ' HG2' ' A' ' 33' ' ' GLN . 29.3 m -135.61 133.75 38.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.054 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.524 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 28.4 t -85.7 160.86 19.44 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.813 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.514 ' CB ' ' HB3' ' A' ' 52' ' ' ARG . 75.1 m-85 -133.36 -39.65 0.91 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.943 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.475 ' O ' ' N ' ' A' ' 51' ' ' SER . . . 154.74 45.52 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.5 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 64.52 -69.32 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.44 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . 0.475 ' N ' ' O ' ' A' ' 49' ' ' GLY . 12.2 m -63.86 -48.06 78.25 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.805 0.336 . . . . 0.0 110.847 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.514 ' HB3' ' CB ' ' A' ' 48' ' ' TYR . 0.2 OUTLIER -56.63 -23.36 40.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.865 179.9 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . 0.495 ' O ' ' CD1' ' A' ' 48' ' ' TYR . . . 68.98 145.43 0.16 Allowed Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.594 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.569 ' CE1' ' SG ' ' A' ' 45' ' ' CYS . 13.1 p90 -86.73 170.05 12.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.872 0.368 . . . . 0.0 110.798 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.431 ' O ' ' HA ' ' A' ' 45' ' ' CYS . 5.0 m120 -141.0 138.28 33.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.728 179.857 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.496 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.5 OUTLIER -117.83 159.97 22.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.105 -179.846 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.454 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.6 pm0 -168.42 172.14 8.55 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.865 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.514 ' HA ' HD12 ' A' ' 43' ' ' LEU . 0.9 OUTLIER -76.5 152.27 36.14 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.872 -179.999 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.953 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.455 -0.221 0 CA-C-O 120.805 0.336 . . . . 0.0 110.483 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.504 ' CB ' HG12 ' A' ' 77' ' ' VAL . 1.6 mp0 -81.24 156.68 25.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.789 179.831 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.459 ' OG1' ' N ' ' A' ' 66' ' ' CYS . 2.6 t 175.37 177.97 0.17 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.996 0.427 . . . . 0.0 111.378 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.459 ' N ' ' OG1' ' A' ' 65' ' ' THR . 0.1 OUTLIER 175.11 -162.34 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.727 -179.989 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.479 ' HA ' ' O ' ' A' ' 73' ' ' ASN . 68.9 t80 -170.07 -38.73 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.045 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 4.6 t70 49.98 88.11 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.757 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.453 ' C ' ' CG ' ' A' ' 70' ' ' TYR . 1.8 mtmt -59.31 159.5 7.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.89 -179.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . 0.453 ' CG ' ' C ' ' A' ' 69' ' ' LYS . 1.0 OUTLIER 77.68 17.35 1.4 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.008 179.981 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 2.9 m -162.86 -44.93 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.234 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 77.0 75.33 0.92 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.581 -0.818 . . . . 0.0 112.49 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . 0.479 ' O ' ' HA ' ' A' ' 67' ' ' PHE . 3.0 m120 -129.42 -172.29 2.71 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.88 0.371 . . . . 0.0 110.808 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 1.3 m -146.8 100.85 3.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.022 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.41 ' N ' ' CD1' ' A' ' 75' ' ' TYR . 3.6 m-30 -92.85 -160.54 0.76 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.81 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . 0.456 ' O ' ' C ' ' A' ' 77' ' ' VAL . 0.4 OUTLIER -142.85 60.51 1.42 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.785 179.825 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.783 ' O ' HG22 ' A' ' 77' ' ' VAL . 6.6 p 29.32 44.71 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.62 179.807 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -160.41 41.55 0.44 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.508 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -160.75 109.06 1.6 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.775 0.321 . . . . 0.0 110.861 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 1.1 t -96.15 172.44 7.98 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.113 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 42.2 p90 -165.54 -174.04 2.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.829 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 -114.77 126.07 54.42 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.832 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 5.0 ttm180 -130.77 90.99 38.45 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.129 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -57.33 120.46 8.39 Favored 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.744 2.296 . . . . 0.0 112.061 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.6 tptp -126.08 146.26 50.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.013 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 60.74 -84.66 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.934 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.1 p -155.81 21.47 0.39 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.017 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 1.8 ttt -144.55 164.71 30.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.881 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.495 ' C ' ' CD1' ' A' ' 90' ' ' TRP . 2.2 mt -99.42 150.99 4.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.139 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' TRP . . . . . 0.584 ' CE3' ' HA ' ' A' ' 106' ' ' ILE . 4.5 m95 -147.08 120.72 9.15 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.867 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -70.82 58.49 0.21 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.985 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . 0.418 ' HA ' ' HA ' ' A' ' 104' ' ' CYS . 84.5 m -45.4 136.24 5.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.871 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 40.9 m -122.72 139.25 54.17 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.146 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.42 ' O ' ' HA ' ' A' ' 77' ' ' VAL . 30.8 t -69.95 68.2 0.29 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.848 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.735 HG22 ' CA ' ' A' ' 100' ' ' GLY . 2.6 mt -77.88 123.21 34.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.276 -179.846 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.68 ' O ' ' HB3' ' A' ' 97' ' ' ALA . . . -145.28 -151.52 5.43 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.515 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.68 ' HB3' ' O ' ' A' ' 96' ' ' GLY . . . 85.17 72.49 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.807 0.337 . . . . 0.0 111.136 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 92.04 -59.27 2.77 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.515 -179.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.446 ' O ' ' HD2' ' A' ' 101' ' ' ARG . 0.0 OUTLIER -163.82 56.96 0.17 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.865 0.364 . . . . 0.0 110.97 -179.966 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 0.735 ' CA ' HG22 ' A' ' 95' ' ' ILE . . . -80.88 -40.1 12.48 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.435 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.458 ' O ' ' O ' ' A' ' 100' ' ' GLY . 0.0 OUTLIER 55.15 115.89 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.833 0.349 . . . . 0.0 110.863 -179.941 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.586 ' N ' HD13 ' A' ' 102' ' ' ILE . 2.2 mm -44.98 94.36 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.121 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.419 ' N ' ' O ' ' A' ' 101' ' ' ARG . 15.5 t -76.65 149.37 36.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.909 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.418 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 92.5 m -132.75 102.69 5.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.961 -179.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 14.8 t -84.81 143.0 29.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.061 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.584 ' HA ' ' CE3' ' A' ' 90' ' ' TRP . 7.3 tt -70.94 140.36 18.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.053 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -103.97 145.54 29.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.115 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -125.18 14.26 8.37 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.955 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 3.1 ttp180 . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.263 -0.875 . . . . 0.0 110.899 -179.95 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo . . . . . 0 C--O 1.232 0.193 0 CA-C-O 120.874 0.281 . . . . 0.0 112.391 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . 0.449 ' HA2' HG13 ' A' ' 30' ' ' ILE . . . 67.68 -143.64 42.41 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.526 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -159.68 52.41 0.35 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.861 0.362 . . . . 0.0 110.954 -179.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.586 ' N ' ' CD2' ' A' ' 27' ' ' HIS . 0.4 OUTLIER -47.88 102.78 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.886 -179.987 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -77.95 -167.24 0.95 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.846 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -43.07 -54.86 4.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.886 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -140.98 8.25 2.71 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.472 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.531 ' HB3' ' CE1' ' A' ' 28' ' ' TYR . 0.1 OUTLIER -127.94 131.47 49.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.79 0.328 . . . . 0.0 110.816 179.988 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . 0.586 ' CD2' ' N ' ' A' ' 22' ' ' TYR . 9.2 t-160 -117.52 88.67 2.96 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.034 -179.766 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.531 ' CE1' ' HB3' ' A' ' 26' ' ' LYS . 6.9 m-85 -79.68 161.71 25.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.888 179.864 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.532 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 4.0 mt-30 -84.73 137.4 33.24 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.618 179.721 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.668 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.9 mp -37.83 147.28 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 120.904 0.383 . . . . 0.0 111.189 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.471 ' HB2' ' O ' ' A' ' 30' ' ' ILE . 26.5 m-80 67.29 11.89 8.63 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.157 179.76 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.532 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 41.7 tt0 -100.33 144.55 29.2 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.785 0.326 . . . . 0.0 110.771 179.726 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 13.2 mt-30 -111.74 156.63 21.6 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.003 0.43 . . . . 0.0 111.278 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . 0.505 ' CZ3' ' HB2' ' A' ' 47' ' ' CYS . 48.3 p90 -163.06 162.67 25.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.641 179.836 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -106.5 124.86 50.23 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.938 0.399 . . . . 0.0 111.1 -179.725 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.485 ' N ' ' O ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -123.52 -169.95 2.03 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.595 179.642 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.3 t -150.26 131.49 14.53 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.161 179.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.607 ' HB2' HD22 ' A' ' 43' ' ' LEU . 20.2 t80 -121.77 139.85 53.08 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.506 179.752 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.453 HD13 ' HE1' ' A' ' 38' ' ' TYR . 0.4 OUTLIER 55.88 20.03 3.91 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.943 0.401 . . . . 0.0 110.387 -179.701 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 78.52 46.21 9.02 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.944 -0.646 . . . . 0.0 112.617 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.425 ' O ' ' C ' ' A' ' 42' ' ' ALA . 35.6 m-80 -151.32 132.21 14.19 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.808 0.337 . . . . 0.0 110.969 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.425 ' C ' ' O ' ' A' ' 41' ' ' ASN . . . -36.04 147.59 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.982 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.607 HD22 ' HB2' ' A' ' 38' ' ' TYR . 1.8 tp -159.53 147.28 17.2 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.07 -179.842 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.507 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 3.2 t -122.21 131.56 72.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.6 179.7 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.57 ' SG ' ' CD1' ' A' ' 54' ' ' PHE . 0.8 OUTLIER -117.47 152.42 35.07 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.268 -179.678 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.455 ' O ' ' CE1' ' A' ' 48' ' ' TYR . 88.4 m -138.78 112.76 8.53 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.02 179.83 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.505 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 8.7 t -77.05 134.58 38.74 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.947 179.898 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.466 ' O ' ' CG2' ' A' ' 30' ' ' ILE . 2.0 m-85 -106.84 -45.34 4.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.926 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.576 ' CA ' HG23 ' A' ' 30' ' ' ILE . . . 117.89 -172.52 14.42 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.508 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 41.42 -112.11 0.35 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.571 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -110.64 -21.15 12.26 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.799 0.333 . . . . 0.0 111.017 -179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 3.8 mtt180 -47.6 -29.84 3.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.824 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 64.6 -124.67 29.63 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.599 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.57 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 8.1 p90 -155.98 155.04 32.06 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.83 0.348 . . . . 0.0 110.864 -179.817 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -124.43 132.63 53.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.719 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.507 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.1 OUTLIER -112.42 160.96 17.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.114 -179.915 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 178.36 171.93 0.72 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.917 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 79.1 p -59.44 116.16 3.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.931 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.417 ' C ' ' HD3' ' A' ' 59' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.973 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 . . . . . 0 N--CA 1.446 -0.637 0 CA-C-O 120.861 0.363 . . . . 0.0 111.146 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -106.06 79.23 1.38 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.806 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.495 ' OG1' ' N ' ' A' ' 66' ' ' CYS . 0.1 OUTLIER -168.9 174.41 6.46 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.185 -179.948 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.495 ' N ' ' OG1' ' A' ' 65' ' ' THR . 1.6 p 173.93 105.06 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.856 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.401 ' CE1' ' HA2' ' A' ' 72' ' ' GLY . 85.3 t80 -62.36 117.46 6.16 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.91 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . 0.489 ' HB2' ' O ' ' A' ' 73' ' ' ASN . 6.1 t0 -89.14 78.87 7.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.865 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.417 ' C ' ' O ' ' A' ' 68' ' ' ASP . 9.4 pttp -36.08 -31.55 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.849 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . 0.473 ' N ' ' O ' ' A' ' 68' ' ' ASP . 5.2 m-85 -40.79 -56.16 2.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.965 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.551 HG21 HD22 ' A' ' 73' ' ' ASN . 12.8 t -126.8 -36.21 2.23 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.166 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . 0.401 ' HA2' ' CE1' ' A' ' 67' ' ' PHE . . . 125.11 10.6 4.62 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.53 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . 0.551 HD22 HG21 ' A' ' 71' ' ' THR . 66.5 m-20 -97.06 140.25 31.85 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.827 0.346 . . . . 0.0 110.848 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 4.1 t -103.92 140.96 36.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.084 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -126.42 -178.62 4.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.797 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -78.48 124.73 28.46 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.87 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.477 HG13 ' N ' ' A' ' 78' ' ' GLY . 8.9 p -46.43 -42.68 5.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.175 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.477 ' N ' HG13 ' A' ' 77' ' ' VAL . . . -86.85 38.34 3.13 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.496 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -123.34 139.52 53.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.814 0.34 . . . . 0.0 110.894 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 24.1 p -111.99 109.32 19.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.093 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . 0.415 ' C ' ' OD1' ' A' ' 91' ' ' ASP . 6.4 p90 -121.04 143.34 49.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.834 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.412 ' HA ' ' HA ' ' A' ' 91' ' ' ASP . 50.0 mt-10 -85.15 175.08 9.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.928 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.443 ' HA ' ' HD2' ' A' ' 84' ' ' PRO . 0.0 OUTLIER -164.98 111.12 0.83 Allowed Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.792 179.952 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.443 ' HD2' ' HA ' ' A' ' 83' ' ' ARG . 25.0 Cg_endo -62.2 137.38 65.78 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.718 2.278 . . . . 0.0 112.277 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -171.77 132.41 0.72 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.901 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 54.71 -160.36 0.16 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.911 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.2 p -89.64 33.71 0.84 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.87 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . 0.506 ' O ' ' NE1' ' A' ' 90' ' ' TRP . 2.6 ttm -162.71 129.54 3.57 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.823 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 1.3 mt -91.67 133.6 32.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.205 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' TRP . . . . . 0.995 ' CZ3' HD11 ' A' ' 106' ' ' ILE . 0.0 OUTLIER -127.5 123.44 35.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.912 179.891 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.415 ' OD1' ' C ' ' A' ' 81' ' ' TYR . 41.8 t0 -76.61 102.02 5.96 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.931 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . 0.5 ' HA ' ' HA ' ' A' ' 104' ' ' CYS . 1.1 m -81.21 117.48 21.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.01 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 30.3 m -88.33 127.64 35.48 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.018 179.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.404 ' O ' ' HA ' ' A' ' 77' ' ' VAL . 0.1 OUTLIER -68.22 86.2 0.27 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.914 -179.919 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 1.2 mt -99.33 61.58 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.352 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.44 ' O ' ' HB3' ' A' ' 97' ' ' ALA . . . -96.71 -114.27 3.07 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.549 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.44 ' HB3' ' O ' ' A' ' 96' ' ' GLY . . . 68.08 20.75 8.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.95 0.405 . . . . 0.0 111.112 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 156.02 -52.58 0.43 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.722 -0.752 . . . . 0.0 112.327 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.438 ' CG ' ' O ' ' A' ' 99' ' ' ARG . 0.0 OUTLIER -133.12 94.12 3.3 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.826 0.346 . . . . 0.0 110.873 179.993 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -36.72 98.35 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.835 -0.698 . . . . 0.0 112.552 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -117.66 48.95 1.28 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.756 0.313 . . . . 0.0 110.813 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.576 ' H ' HD12 ' A' ' 102' ' ' ILE . 2.2 mp -56.22 102.55 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.192 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 32.5 t -98.6 129.42 45.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.738 179.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.5 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 0.7 OUTLIER -99.53 148.41 24.3 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.97 0.414 . . . . 0.0 111.033 -179.888 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -157.05 112.48 2.85 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.061 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.995 HD11 ' CZ3' ' A' ' 90' ' ' TRP . 3.3 mp -40.3 131.95 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.173 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -96.27 108.56 21.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.083 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 3.8 p30 -132.08 36.21 3.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.906 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 9.2 mtp85 . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.945 -179.955 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo . . . . . 0 C--O 1.231 0.163 0 CA-C-O 120.806 0.252 . . . . 0.0 112.275 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 95.4 177.76 37.18 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.384 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 69.6 m -112.58 126.58 55.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.81 0.338 . . . . 0.0 110.877 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 15.0 t80 -119.39 121.47 39.6 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.975 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.423 ' O ' ' C ' ' A' ' 24' ' ' ASN . 2.0 t0 -99.33 -162.5 0.96 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.942 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.423 ' C ' ' O ' ' A' ' 23' ' ' ASP . 7.9 t-20 -35.81 -53.14 0.73 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.954 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -153.64 20.76 0.7 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.588 -179.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.42 ' HB3' ' CE2' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -121.41 132.66 54.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.889 0.376 . . . . 0.0 110.952 179.868 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 13.5 t-160 -115.0 91.56 3.65 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.096 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.463 ' HB3' ' OE1' ' A' ' 32' ' ' GLN . 0.1 OUTLIER -83.15 -178.39 7.09 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.929 179.915 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.524 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 1.7 tt0 -114.21 152.41 31.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.548 179.636 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.688 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.4 mp -49.47 154.03 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.153 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 10.7 m-20 59.53 17.95 6.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.02 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.524 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 2.2 tt0 -105.25 142.54 34.84 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.81 179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.428 ' CG ' HG23 ' A' ' 46' ' ' THR . 24.9 mt-30 -115.93 140.71 48.97 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.05 -179.76 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . 0.604 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 39.6 p90 -148.5 -173.34 4.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.807 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.671 ' OE2' ' HB1' ' A' ' 42' ' ' ALA . 61.6 tt0 -120.01 121.67 39.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.925 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.844 ' O ' HD22 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -106.81 156.45 18.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.821 179.982 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.3 m -110.09 139.43 45.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.678 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.491 ' N ' HD21 ' A' ' 43' ' ' LEU . 1.0 OUTLIER -155.2 110.65 3.07 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.783 179.827 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 66.56 38.2 4.22 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.613 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 65.31 44.85 92.91 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.446 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.502 ' HB2' HD11 ' A' ' 43' ' ' LEU . 19.4 m120 -135.78 175.09 9.91 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 120.811 0.338 . . . . 0.0 110.933 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.932 ' C ' HD13 ' A' ' 43' ' ' LEU . . . -117.1 104.15 10.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.905 179.834 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.932 HD13 ' C ' ' A' ' 42' ' ' ALA . 0.0 OUTLIER -114.73 118.92 34.98 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.25 -179.786 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.481 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.7 t -71.13 128.48 34.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.369 179.368 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.604 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 1.9 m -106.17 157.82 17.28 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.148 -179.598 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.443 ' O ' ' CE1' ' A' ' 48' ' ' TYR . 8.6 m -146.63 121.51 9.97 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.083 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.477 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 18.3 t -79.95 134.29 36.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.97 -179.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.481 ' HB2' ' HB3' ' A' ' 52' ' ' ARG . 1.4 m-85 -104.95 -45.94 4.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.983 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 114.13 -173.86 15.19 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.423 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 39.81 -129.92 2.54 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.535 179.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 18.0 m -102.27 26.13 8.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.767 0.318 . . . . 0.0 110.964 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.481 ' HB3' ' HB2' ' A' ' 48' ' ' TYR . 9.0 mmt180 -87.57 -47.24 8.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.173 -179.846 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 65.3 160.77 0.62 Allowed Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.507 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.573 ' CE1' ' SG ' ' A' ' 45' ' ' CYS . 0.6 OUTLIER -73.99 149.95 41.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.822 0.344 . . . . 0.0 110.835 -179.993 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -112.38 -45.86 3.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.966 -179.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.481 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.1 OUTLIER 72.39 146.16 0.08 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.889 -179.966 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.408 ' CG ' ' N ' ' A' ' 58' ' ' SER . 0.9 OUTLIER -124.48 -89.94 0.57 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.933 179.958 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.497 ' HA ' ' HA ' ' A' ' 43' ' ' LEU . 67.4 m -165.45 177.34 7.54 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.713 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.486 ' HB2' ' HB3' ' A' ' 42' ' ' ALA . 0.7 OUTLIER . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.793 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.421 ' HG3' ' N ' ' A' ' 64' ' ' GLU . 1.1 tt0 . . . . . 0 N--CA 1.455 -0.189 0 CA-C-O 120.797 0.332 . . . . 0.0 110.592 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.421 ' N ' ' HG3' ' A' ' 63' ' ' GLU . 16.8 tt0 -127.13 51.18 1.91 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.964 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -165.91 143.64 5.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.114 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 5.1 m -124.59 -172.17 2.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.766 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.565 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 87.8 t80 -161.78 118.59 2.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.067 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . 0.428 ' O ' ' C ' ' A' ' 69' ' ' LYS . 3.7 t0 -92.22 76.79 5.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.728 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.565 ' HA ' ' CE2' ' A' ' 67' ' ' PHE . 1.3 ptmt -35.18 -35.85 0.05 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.984 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . 0.418 ' N ' ' O ' ' A' ' 68' ' ' ASP . 18.6 m-30 -40.29 -57.24 1.79 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.911 179.875 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 20.5 p -140.48 32.33 1.87 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.105 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 46.36 95.45 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.54 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . 0.477 ' O ' ' HA ' ' A' ' 67' ' ' PHE . 2.0 m-80 -147.18 162.88 37.98 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.792 0.33 . . . . 0.0 110.983 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -132.87 104.59 6.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.154 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.592 ' CD2' ' CE1' ' A' ' 81' ' ' TYR . 0.7 OUTLIER -108.45 13.54 25.38 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.882 -179.926 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . 0.427 ' O ' ' O ' ' A' ' 75' ' ' TYR . 70.9 mtt85 49.15 178.71 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.767 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.703 ' O ' HG22 ' A' ' 77' ' ' VAL . 12.2 p -95.53 28.17 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.153 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -146.44 14.15 1.61 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.424 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -134.01 127.53 32.49 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.811 0.338 . . . . 0.0 111.02 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.654 HG22 ' CG2' ' A' ' 93' ' ' THR . 22.2 p -92.51 164.16 13.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.118 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . 0.592 ' CE1' ' CD2' ' A' ' 75' ' ' TYR . 47.9 p90 -158.55 166.1 32.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.92 -179.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -117.18 116.32 27.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.804 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 20.8 mmt-85 -118.23 117.05 35.24 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.946 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -71.96 106.94 2.11 Favored 'Trans proline' 0 C--N 1.342 0.222 0 C-N-CA 122.7 2.267 . . . . 0.0 112.291 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.463 ' O ' ' CB ' ' A' ' 86' ' ' ASP . 1.5 mmpp? -117.61 107.87 14.76 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.876 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.463 ' CB ' ' O ' ' A' ' 85' ' ' LYS . 0.4 OUTLIER 81.85 -153.7 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.801 -179.965 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -81.11 6.95 12.2 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.067 179.904 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 1.4 tpt -137.92 149.22 46.01 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.861 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.53 ' C ' ' CD1' ' A' ' 90' ' ' TRP . 1.4 mt -110.36 154.2 11.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.198 -179.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' TRP . . . . . 0.631 ' CD1' ' N ' ' A' ' 90' ' ' TRP . 0.1 OUTLIER -143.23 150.04 38.77 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.776 179.912 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.451 ' OD1' ' HB3' ' A' ' 108' ' ' ASN . 0.2 OUTLIER -83.28 65.38 8.25 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.957 179.979 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . 0.41 ' HA ' ' HA ' ' A' ' 104' ' ' CYS . 21.4 m -48.12 137.14 10.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.111 179.928 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.654 ' CG2' HG22 ' A' ' 80' ' ' THR . 18.3 m -145.08 137.52 26.04 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.068 179.878 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.404 ' HB2' ' CD1' ' A' ' 75' ' ' TYR . 5.1 t -74.42 71.82 1.81 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.942 -179.827 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.51 HG22 ' O ' ' A' ' 95' ' ' ILE . 2.3 mt -81.25 66.66 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.296 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.638 ' O ' ' HB3' ' A' ' 97' ' ' ALA . . . 153.1 -83.24 0.16 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.375 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.638 ' HB3' ' O ' ' A' ' 96' ' ' GLY . . . 80.18 80.71 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.803 0.335 . . . . 0.0 111.137 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.54 0.02 86.58 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.589 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 17.9 mtp85 -139.73 -55.53 0.56 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.814 0.34 . . . . 0.0 110.981 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 0.427 ' O ' ' HB3' ' A' ' 101' ' ' ARG . . . -85.61 -103.96 0.7 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.473 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.427 ' HB3' ' O ' ' A' ' 100' ' ' GLY . 0.0 OUTLIER 179.73 169.51 1.15 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.766 0.317 . . . . 0.0 110.895 -179.925 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 3.7 mt -97.1 64.77 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.079 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 19.2 t -45.42 155.95 0.13 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.852 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.41 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 81.1 m -150.97 96.36 2.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.945 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . 0.441 ' O ' ' N ' ' A' ' 91' ' ' ASP . 0.1 OUTLIER -91.37 150.89 21.08 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.129 -179.965 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.498 HG13 ' CE3' ' A' ' 90' ' ' TRP . 2.3 mp -65.79 144.5 14.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.048 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . 43.64 -163.9 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.086 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . 0.464 ' OD1' ' N ' ' A' ' 108' ' ' ASN . 4.7 p-10 -146.95 157.25 43.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.83 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . 0.448 ' HG2' ' O ' ' A' ' 108' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.959 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo . . . . . 0 N--CA 1.464 -0.263 0 CA-C-O 120.855 0.273 . . . . 0.0 112.312 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . 0.416 ' HA3' ' CE1' ' A' ' 27' ' ' HIS . . . 138.36 -151.72 21.63 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.665 -0.779 . . . . 0.0 112.615 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -158.07 64.83 0.45 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.852 0.358 . . . . 0.0 110.831 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -45.46 137.89 4.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.841 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -162.99 119.82 1.88 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.891 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.404 ' O ' ' CG ' ' A' ' 24' ' ' ASN . 36.6 t30 54.79 30.4 13.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.919 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 85.64 -10.33 65.11 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.539 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.84 128.19 39.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.813 0.34 . . . . 0.0 110.862 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . 0.416 ' CE1' ' HA3' ' A' ' 20' ' ' GLY . 28.6 t-80 -115.28 94.26 4.65 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.193 -179.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -81.71 -168.97 2.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.803 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.531 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 43.1 tt0 -106.01 141.41 37.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.851 179.862 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.694 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.6 mp -48.97 146.14 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.252 -179.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.405 ' OD1' HG22 ' A' ' 30' ' ' ILE . 0.6 OUTLIER 67.5 12.64 9.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.901 -179.998 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.531 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 52.6 tt0 -98.65 151.63 20.49 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.637 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 18.9 mt-30 -114.57 152.35 31.92 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.096 -179.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . 0.56 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 43.4 p90 -153.05 179.08 9.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.78 179.783 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -109.74 127.73 54.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.866 0.365 . . . . 0.0 111.305 -179.662 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.521 ' O ' ' N ' ' A' ' 43' ' ' LEU . 39.5 ttt-85 -133.4 171.67 13.74 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.341 179.631 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.433 ' HG1' ' C ' ' A' ' 41' ' ' ASN . 1.5 t -135.29 139.88 44.71 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.782 0.325 . . . . 0.0 111.352 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.487 ' HB2' HD22 ' A' ' 43' ' ' LEU . 3.6 t80 -126.79 126.61 43.7 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.638 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.456 HD13 ' HA ' ' A' ' 39' ' ' LEU . 2.9 mm? 63.11 25.78 15.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.574 -179.734 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 76.22 43.07 21.97 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 121.041 -0.599 . . . . 0.0 112.667 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.433 ' C ' ' HG1' ' A' ' 37' ' ' THR . 32.6 m120 -145.56 129.86 17.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.796 0.331 . . . . 0.0 111.074 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.429 ' C ' ' O ' ' A' ' 41' ' ' ASN . . . -37.5 153.98 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.458 179.687 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.521 ' N ' ' O ' ' A' ' 36' ' ' ARG . 4.4 tp -169.52 161.34 9.59 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.082 0.468 . . . . 0.0 111.618 -179.527 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.492 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 19.6 t -124.36 155.88 32.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.232 179.267 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.57 ' SG ' ' CD1' ' A' ' 54' ' ' PHE . 0.5 OUTLIER -139.46 150.46 45.22 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.939 0.4 . . . . 0.0 111.423 -179.618 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 97.9 m -133.89 115.98 15.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.811 179.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.507 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 36.9 t -71.73 156.35 39.44 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.971 -179.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.524 ' O ' ' CG2' ' A' ' 30' ' ' ILE . 42.3 m-85 -119.25 -53.28 2.25 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.151 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.495 ' HA2' HG23 ' A' ' 30' ' ' ILE . . . 156.82 52.49 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.456 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 48.63 50.21 25.69 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.526 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -149.4 -61.6 0.22 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.832 0.349 . . . . 0.0 110.842 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.524 ' NE ' ' HA ' ' A' ' 52' ' ' ARG . 8.5 mmm180 -68.46 -31.6 71.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.781 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . 0.577 ' O ' ' CD2' ' A' ' 54' ' ' PHE . . . 88.02 24.3 35.33 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 120.881 -0.676 . . . . 0.0 112.533 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.577 ' CD2' ' O ' ' A' ' 53' ' ' GLY . 1.5 p90 56.04 151.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.943 0.402 . . . . 0.0 111.106 179.839 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.401 ' O ' ' OD1' ' A' ' 55' ' ' ASN . 43.6 p-10 -130.44 109.38 10.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.64 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.492 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.7 OUTLIER -83.73 170.06 14.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.103 -179.855 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 172.31 166.76 0.11 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.963 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.438 ' HA ' HD12 ' A' ' 43' ' ' LEU . 5.0 t -58.6 154.68 13.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.951 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.835 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.522 ' OE2' ' HB2' ' A' ' 97' ' ' ALA . 0.8 OUTLIER . . . . . 0 CA--C 1.529 0.154 0 CA-C-O 120.765 0.316 . . . . 0.0 110.503 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.515 ' CB ' HG21 ' A' ' 77' ' ' VAL . 0.1 OUTLIER 179.5 -166.38 0.07 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.894 -179.968 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.422 HG23 ' C ' ' A' ' 64' ' ' GLU . 30.5 p -158.02 146.03 18.66 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.215 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.623 ' O ' HG23 ' A' ' 74' ' ' THR . 25.9 p -121.43 -175.81 3.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.788 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.529 ' CE1' ' HA2' ' A' ' 72' ' ' GLY . 76.6 t80 -137.78 127.79 25.77 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.922 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 33.3 t0 -92.1 92.64 8.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.909 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.476 ' HA ' ' CE2' ' A' ' 67' ' ' PHE . 0.8 OUTLIER -47.79 -25.44 1.27 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.005 -179.967 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . 0.418 ' C ' ' O ' ' A' ' 69' ' ' LYS . 8.2 m-30 -36.27 -59.37 0.63 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.829 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -159.77 30.51 0.19 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.15 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . 0.529 ' HA2' ' CE1' ' A' ' 67' ' ' PHE . . . 71.88 74.48 0.74 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.674 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -138.45 90.83 2.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.723 0.297 . . . . 0.0 110.714 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.623 HG23 ' O ' ' A' ' 66' ' ' CYS . 34.0 m -69.11 137.32 53.34 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.146 -179.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.441 ' CD2' ' CE1' ' A' ' 81' ' ' TYR . 66.3 m-85 -126.95 155.55 42.93 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.794 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 11.5 mtp180 -84.22 127.82 34.19 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.917 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.515 HG21 ' CB ' ' A' ' 64' ' ' GLU . 43.0 t -44.72 -27.03 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.108 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -90.08 26.71 9.38 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.589 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -158.39 134.88 9.47 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.826 0.346 . . . . 0.0 111.0 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 5.3 t -111.17 165.28 12.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.905 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . 0.441 ' CE1' ' CD2' ' A' ' 75' ' ' TYR . 19.1 p90 -143.73 173.86 11.31 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.892 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -148.46 110.76 4.65 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.773 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.3 143.56 47.63 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.963 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -68.09 139.0 45.31 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.84 2.36 . . . . 0.0 112.29 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.431 ' O ' ' O ' ' A' ' 88' ' ' MET . 0.1 OUTLIER -160.47 133.58 6.63 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.899 179.943 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.404 ' O ' ' OG ' ' A' ' 87' ' ' SER . 0.9 OUTLIER 56.48 52.16 10.31 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.906 179.989 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . 0.404 ' OG ' ' O ' ' A' ' 86' ' ' ASP . 1.8 p 53.38 23.16 3.17 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.878 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . 0.431 ' O ' ' O ' ' A' ' 85' ' ' LYS . 0.2 OUTLIER -150.49 143.67 24.88 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.915 179.925 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 4.4 mt -108.5 136.53 43.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.166 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' TRP . . . . . 0.796 ' CZ3' HD11 ' A' ' 106' ' ' ILE . 0.1 OUTLIER -131.18 140.86 49.98 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.74 179.955 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -79.57 52.67 1.44 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.699 179.887 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . 0.462 ' HA ' ' HA ' ' A' ' 104' ' ' CYS . 70.9 m -41.43 111.29 0.21 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.087 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.486 ' O ' ' N ' ' A' ' 95' ' ' ILE . 51.9 m -98.34 132.87 43.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.894 179.83 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 43.5 t -65.89 61.98 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.935 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.486 ' N ' ' O ' ' A' ' 93' ' ' THR . 2.5 mt -69.62 105.23 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.205 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.434 ' O ' ' HB3' ' A' ' 97' ' ' ALA . . . -142.56 -119.23 1.43 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.635 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.522 ' HB2' ' OE2' ' A' ' 63' ' ' GLU . . . 67.47 -74.35 0.07 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.831 0.348 . . . . 0.0 110.981 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -128.64 80.41 0.36 Allowed Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.827 -0.702 . . . . 0.0 112.318 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 2.2 mtt-85 62.75 13.35 6.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.811 0.339 . . . . 0.0 110.675 -179.795 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 0.485 ' CA ' HG22 ' A' ' 95' ' ' ILE . . . -43.72 -52.09 6.66 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.601 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.449 ' HB3' ' O ' ' A' ' 100' ' ' GLY . 0.0 OUTLIER 68.39 112.44 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.806 0.336 . . . . 0.0 110.73 -179.945 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.43 ' C ' ' O ' ' A' ' 101' ' ' ARG . 2.3 mp -34.95 151.53 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.224 -179.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 4.7 t -146.04 128.91 16.36 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.831 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.462 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 70.9 m -111.66 138.29 48.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.096 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -144.46 140.73 29.12 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.891 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.796 HD11 ' CZ3' ' A' ' 90' ' ' TRP . 2.8 mp -82.0 114.16 22.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.106 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -113.48 143.82 43.87 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.165 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 7.0 p-10 -123.61 115.57 21.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.949 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.248 0.992 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.88 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo . . . . . 0 N--CA 1.465 -0.193 0 CA-C-O 120.827 0.261 . . . . 0.0 112.206 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . 0.417 ' C ' ' SG ' ' A' ' 21' ' ' CYS . . . 160.99 -153.26 24.06 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.482 -179.833 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.417 ' SG ' ' C ' ' A' ' 20' ' ' GLY . 0.0 OUTLIER -159.82 93.0 1.06 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.844 0.354 . . . . 0.0 110.828 179.985 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.468 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 6.5 t80 -96.26 101.34 12.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.96 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.494 ' OD2' ' CE2' ' A' ' 54' ' ' PHE . 9.5 t70 -128.4 133.72 48.66 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.858 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 45.6 t30 51.66 28.44 4.77 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.015 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 86.61 -2.22 87.28 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.519 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.592 ' HB3' ' CZ ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -95.7 137.84 34.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.831 0.348 . . . . 0.0 110.95 179.913 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 -114.37 85.76 2.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.906 -179.794 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.592 ' CZ ' ' HB3' ' A' ' 26' ' ' LYS . 2.3 m-85 -79.64 176.48 9.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.961 -179.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.513 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 1.2 tt0 -104.09 136.91 42.84 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.56 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.67 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.8 mp -40.76 146.85 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.33 -179.877 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.461 ' HB2' ' O ' ' A' ' 30' ' ' ILE . 69.7 m-80 67.9 10.68 7.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.303 179.71 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.513 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 59.9 tt0 -94.62 149.29 21.39 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.806 0.336 . . . . 0.0 110.828 179.79 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.424 ' CG ' HG23 ' A' ' 46' ' ' THR . 19.2 mt-30 -113.38 147.19 38.2 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.209 -179.744 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . 0.519 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 42.6 p90 -157.27 -164.45 1.59 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.494 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.64 ' OE1' ' HB1' ' A' ' 42' ' ' ALA . 1.4 tm-20 -128.89 122.73 30.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.86 0.362 . . . . 0.0 111.191 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.666 ' O ' HD22 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -114.92 131.19 56.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.546 179.751 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.4 m -99.83 129.41 45.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.681 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.474 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 1.5 t80 -145.14 112.59 6.18 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.854 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.474 ' HB2' ' O ' ' A' ' 38' ' ' TYR . 0.3 OUTLIER 77.74 56.97 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.658 -179.924 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 48.91 28.94 7.77 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.357 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 34.7 m-80 -140.45 138.85 35.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.795 0.331 . . . . 0.0 110.995 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 1.029 ' C ' HD13 ' A' ' 43' ' ' LEU . . . -87.81 126.43 35.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.169 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 1.029 HD13 ' C ' ' A' ' 42' ' ' ALA . 0.0 OUTLIER -124.34 123.03 39.31 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.306 -0.407 . . . . 0.0 111.175 -179.965 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.48 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.7 t -67.15 133.24 31.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.337 -0.392 . . . . 0.0 109.972 179.17 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.571 ' SG ' ' CD1' ' A' ' 54' ' ' PHE . 1.6 m -115.0 167.35 10.88 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.05 0.452 . . . . 0.0 111.76 -179.037 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.497 ' O ' ' CE1' ' A' ' 48' ' ' TYR . 7.2 m -157.96 118.34 3.39 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.773 -0.648 . . . . 0.0 110.697 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.493 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 12.4 t -78.27 136.05 37.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.207 -179.584 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.501 ' HB2' ' HB2' ' A' ' 52' ' ' ARG . 5.4 m-85 -111.07 -32.29 6.84 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.908 179.848 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 76.6 -170.82 54.98 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.486 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . 0.526 ' O ' ' CB ' ' A' ' 51' ' ' SER . . . 54.4 25.46 34.08 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.522 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . 0.526 ' CB ' ' O ' ' A' ' 50' ' ' GLY . 3.2 m 85.06 -13.29 0.67 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.835 0.35 . . . . 0.0 111.157 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.501 ' HB2' ' HB2' ' A' ' 48' ' ' TYR . 60.7 mtt180 -57.58 -28.85 63.97 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.929 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 58.74 168.65 0.2 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.454 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.571 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 7.6 p90 -84.11 146.66 27.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.765 0.316 . . . . 0.0 110.815 -179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -101.95 -47.82 4.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.018 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.49 ' HA ' ' HA ' ' A' ' 45' ' ' CYS . 0.1 OUTLIER 71.31 159.42 0.21 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.813 -179.881 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.4 ' CG ' ' N ' ' A' ' 58' ' ' SER . 1.5 tp10 -141.65 -93.5 0.14 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.15 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.506 ' HA ' ' HA ' ' A' ' 43' ' ' LEU . 21.7 m -171.63 160.96 5.98 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.88 0.371 . . . . 0.0 111.02 -179.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 11.7 tmtt? . . . . . 0 C--N 1.328 -0.339 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.804 179.907 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.447 ' HG3' ' N ' ' A' ' 64' ' ' GLU . 1.9 tt0 . . . . . 0 N--CA 1.455 -0.221 0 CA-C-O 120.919 0.39 . . . . 0.0 110.544 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.447 ' N ' ' HG3' ' A' ' 63' ' ' GLU . 13.6 tt0 -169.46 46.07 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.933 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.622 HG22 ' CG2' ' A' ' 74' ' ' THR . 0.0 OUTLIER -142.15 166.5 24.54 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.211 179.907 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.521 ' HA ' ' CA ' ' A' ' 98' ' ' GLY . 3.8 m -149.95 -176.03 5.28 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.917 -179.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.577 ' CE2' ' HA2' ' A' ' 72' ' ' GLY . 27.8 t80 -178.61 93.62 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.887 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . 0.468 ' O ' ' O ' ' A' ' 69' ' ' LYS . 13.6 t70 -93.98 38.18 1.08 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.928 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.471 ' HA ' ' CE1' ' A' ' 67' ' ' PHE . 1.3 pttt 36.6 -159.73 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.953 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . 0.458 ' HB2' ' O ' ' A' ' 69' ' ' LYS . 21.9 m-85 73.32 -54.71 0.69 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.964 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 13.2 p -135.14 12.97 3.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.027 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . 0.577 ' HA2' ' CE2' ' A' ' 67' ' ' PHE . . . 46.43 24.63 1.72 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.564 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . 0.463 ' HB3' ' CE1' ' A' ' 75' ' ' TYR . 1.1 t-20 -72.21 109.6 6.07 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.758 0.314 . . . . 0.0 110.929 -179.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.622 ' CG2' HG22 ' A' ' 65' ' ' THR . 92.3 m -78.48 112.11 15.2 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.015 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.659 ' CE2' ' CE2' ' A' ' 81' ' ' TYR . 9.1 m-85 -94.37 -175.77 3.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.898 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . 0.447 ' HD2' ' HA ' ' A' ' 76' ' ' ARG . 0.2 OUTLIER -104.61 126.46 51.72 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.819 179.991 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.596 HG23 ' N ' ' A' ' 65' ' ' THR . 31.9 t -62.62 -14.94 14.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.213 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -102.39 16.2 55.4 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.475 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -155.69 163.74 39.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.812 0.339 . . . . 0.0 110.922 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.462 HG22 HG23 ' A' ' 93' ' ' THR . 30.6 p -95.99 167.39 11.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.217 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . 0.659 ' CE2' ' CE2' ' A' ' 75' ' ' TYR . 15.6 p90 -146.2 131.68 18.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.858 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.608 ' OE2' HG22 ' A' ' 89' ' ' ILE . 0.8 OUTLIER -70.96 113.32 7.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.02 -179.951 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.511 ' NE ' ' HA ' ' A' ' 83' ' ' ARG . 0.7 OUTLIER -120.71 81.22 32.88 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.768 179.822 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_exo -44.58 116.6 1.15 Allowed 'Trans proline' 0 N--CA 1.465 -0.173 0 C-N-CA 122.877 2.385 . . . . 0.0 112.433 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -132.66 122.11 24.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.897 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 3.7 t0 72.84 -156.53 0.08 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.84 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.17 8.04 12.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.952 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -128.64 160.32 32.8 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.915 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.948 ' O ' HG23 ' A' ' 106' ' ' ILE . 2.6 mp -107.81 128.18 63.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.027 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' TRP . . . . . 0.696 ' CZ3' HD11 ' A' ' 106' ' ' ILE . 1.0 OUTLIER -122.21 136.5 54.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.981 -179.987 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -93.15 57.81 2.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.803 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . 0.474 ' HA ' ' HA ' ' A' ' 104' ' ' CYS . 0.7 OUTLIER -38.21 151.63 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.095 -179.94 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.462 HG23 HG22 ' A' ' 80' ' ' THR . 88.7 m -128.2 128.71 45.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.977 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.436 ' HB3' ' HA ' ' A' ' 77' ' ' VAL . 16.2 t -64.66 88.3 0.06 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.01 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.429 ' HB ' ' O ' ' A' ' 101' ' ' ARG . 0.8 OUTLIER -101.8 46.62 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.168 179.998 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 172.64 -159.6 30.37 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.476 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -90.98 63.65 5.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.836 0.351 . . . . 0.0 111.044 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . 0.521 ' CA ' ' HA ' ' A' ' 66' ' ' CYS . . . 68.12 10.36 59.15 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.489 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 171.59 51.32 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.838 0.351 . . . . 0.0 110.945 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -111.88 -62.13 0.46 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.371 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.429 ' O ' ' HB ' ' A' ' 95' ' ' ILE . 0.4 OUTLIER -141.45 38.89 1.71 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.95 0.405 . . . . 0.0 110.827 179.808 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.455 HG21 ' OH ' ' A' ' 81' ' ' TYR . 2.7 mt -56.96 89.25 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.168 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.41 ' O ' ' HA ' ' A' ' 92' ' ' CYS . 27.0 t -84.71 138.72 32.48 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.791 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.474 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 0.5 OUTLIER -110.93 141.63 44.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.982 -179.931 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 1.5 t -156.89 121.55 4.48 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.054 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.948 HG23 ' O ' ' A' ' 89' ' ' ILE . 1.7 mp -66.48 138.84 22.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.086 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -64.65 106.2 1.13 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.167 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -105.61 111.68 24.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.876 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.252 -0.88 . . . . 0.0 110.971 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo . . . . . 0 C--O 1.232 0.223 0 CA-C-O 120.963 0.318 . . . . 0.0 112.391 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 73.11 -154.44 49.53 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.873 -0.679 . . . . 0.0 112.455 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 85.0 m -138.99 135.16 34.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.837 0.351 . . . . 0.0 110.922 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 47.7 t80 -110.3 119.84 40.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.877 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -167.73 151.61 6.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.916 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.491 ' ND2' ' O ' ' A' ' 24' ' ' ASN . 17.6 t30 55.35 51.03 13.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.908 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 47.56 23.26 2.07 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.482 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.554 ' HB3' ' CE2' ' A' ' 28' ' ' TYR . 0.1 OUTLIER -132.29 139.12 48.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.842 0.353 . . . . 0.0 110.865 -179.977 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -109.23 85.9 2.19 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.947 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.554 ' CE2' ' HB3' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -79.84 165.15 23.0 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.815 179.948 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.523 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 0.0 OUTLIER -100.25 162.33 13.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.741 179.806 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.681 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.5 mp -49.53 156.23 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.351 -179.868 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.43 ' N ' HG22 ' A' ' 30' ' ' ILE . 1.7 m-80 56.86 19.65 4.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.066 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.523 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 10.1 tt0 -101.29 147.69 26.0 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.825 0.345 . . . . 0.0 110.91 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 14.2 mt-30 -116.75 145.46 43.47 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.016 -179.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . 0.6 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 42.0 p90 -150.35 168.88 22.79 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.785 179.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 76.2 tt0 -101.15 126.53 47.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.171 -179.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.471 ' HB2' ' SG ' ' A' ' 56' ' ' CYS . 1.5 mtp180 -119.4 176.95 5.1 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.674 179.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -144.61 132.46 21.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.701 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.524 ' HB2' HD22 ' A' ' 43' ' ' LEU . 0.6 OUTLIER -154.76 143.59 20.84 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.678 179.671 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.463 ' HB2' ' O ' ' A' ' 38' ' ' TYR . 3.4 mm? 66.76 22.51 10.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.484 -179.678 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 69.69 38.85 77.74 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.531 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -152.08 153.3 33.66 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-O 120.708 0.29 . . . . 0.0 110.984 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.88 ' O ' HD12 ' A' ' 43' ' ' LEU . . . -60.75 146.58 45.44 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.946 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.88 HD12 ' O ' ' A' ' 42' ' ' ALA . 4.3 mp -142.18 161.5 37.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.929 0.395 . . . . 0.0 111.364 -179.674 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.499 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.2 t -128.9 123.65 59.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.244 179.353 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.6 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 1.3 m -109.8 158.76 17.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.618 -179.263 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 24.7 m -146.38 119.53 8.86 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.797 179.644 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.544 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 28.7 t -74.16 143.69 45.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.158 -179.795 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.461 ' N ' ' O ' ' A' ' 53' ' ' GLY . 26.2 m-85 -119.4 -24.66 6.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.948 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 123.87 -169.07 15.98 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.453 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . 0.516 ' O ' ' CB ' ' A' ' 51' ' ' SER . . . -75.17 85.94 0.8 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.601 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . 0.516 ' CB ' ' O ' ' A' ' 50' ' ' GLY . 0.3 OUTLIER 160.0 -62.91 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.823 0.344 . . . . 0.0 110.849 179.976 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -85.07 -29.94 24.49 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.024 -179.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . 0.461 ' O ' ' N ' ' A' ' 48' ' ' TYR . . . 70.34 -111.51 3.82 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.522 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.566 ' CE1' ' SG ' ' A' ' 45' ' ' CYS . 1.8 p90 -153.65 154.21 33.74 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.893 0.378 . . . . 0.0 110.886 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -133.2 93.96 3.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.622 179.777 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.499 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.4 OUTLIER -68.0 166.79 15.13 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.146 -179.673 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.491 ' HG2' ' N ' ' A' ' 58' ' ' SER . 14.6 tt0 -152.75 -89.69 0.05 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.131 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.491 ' N ' ' HG2' ' A' ' 57' ' ' GLU . 0.1 OUTLIER -164.49 -167.18 1.22 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.976 179.953 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.972 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.649 ' O ' ' HB2' ' A' ' 97' ' ' ALA . 2.8 tt0 . . . . . 0 N--CA 1.456 -0.16 0 CA-C-O 120.903 0.383 . . . . 0.0 110.452 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -66.57 -169.02 0.07 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.826 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 7.2 p 48.01 -177.56 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.18 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.42 ' SG ' ' HB2' ' A' ' 75' ' ' TYR . 18.5 p -150.12 -156.33 0.71 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.791 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.465 ' O ' ' N ' ' A' ' 69' ' ' LYS . 12.6 t80 -168.32 81.77 0.17 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.891 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -52.74 87.08 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.872 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.465 ' N ' ' O ' ' A' ' 67' ' ' PHE . 2.0 pttt -52.67 -29.84 28.68 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.862 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . 0.403 ' C ' ' O ' ' A' ' 69' ' ' LYS . 8.3 m-30 -38.4 -56.49 1.24 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.903 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -122.58 -8.08 8.55 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.09 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 80.12 69.67 1.38 Allowed Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.511 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 12.8 m120 -122.37 -162.88 1.03 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.942 0.401 . . . . 0.0 110.965 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 18.0 m -144.39 105.21 4.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.976 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.42 ' HB2' ' SG ' ' A' ' 66' ' ' CYS . 19.3 m-85 -120.68 160.38 23.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.747 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -91.58 146.56 23.69 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.797 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 93.7 t -45.59 -37.74 2.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.096 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -95.39 14.8 64.46 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.515 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -107.52 100.69 10.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.922 0.391 . . . . 0.0 110.996 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.876 HG22 HG23 ' A' ' 93' ' ' THR . 64.6 p -73.98 143.6 45.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.205 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . 0.743 ' OH ' HG21 ' A' ' 102' ' ' ILE . 42.2 p90 -133.88 109.98 9.42 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.784 179.842 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -50.4 168.24 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.083 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -167.66 86.58 0.75 Allowed Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.801 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo -69.13 91.94 0.45 Allowed 'Trans proline' 0 C--O 1.232 0.195 0 C-N-CA 122.734 2.289 . . . . 0.0 112.402 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 2.8 mttt -128.26 132.54 48.72 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.788 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 4.8 t0 74.95 10.23 3.85 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.884 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 66.3 30.4 9.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.852 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . 0.433 ' HG3' HG12 ' A' ' 106' ' ' ILE . 2.3 tpt -120.45 -29.91 4.67 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.919 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.448 ' C ' ' CD1' ' A' ' 90' ' ' TRP . 84.4 mt 58.77 129.02 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.057 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' TRP . . . . . 0.758 ' CH2' HD11 ' A' ' 106' ' ' ILE . 0.7 OUTLIER -136.15 132.49 36.07 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.852 -179.992 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.468 ' N ' ' O ' ' A' ' 105' ' ' THR . 0.5 OUTLIER -70.77 62.22 0.27 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.865 -179.972 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 64.2 m -51.48 136.74 25.39 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.998 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.876 HG23 HG22 ' A' ' 80' ' ' THR . 0.2 OUTLIER -126.84 124.83 40.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.912 179.872 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.52 ' HA ' HG23 ' A' ' 102' ' ' ILE . 0.5 OUTLIER -60.37 73.14 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.938 -179.897 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.517 ' N ' ' O ' ' A' ' 93' ' ' THR . 1.9 mt -88.89 58.81 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.238 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 174.24 161.85 24.91 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.481 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.649 ' HB2' ' O ' ' A' ' 63' ' ' GLU . . . -107.71 53.32 0.69 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.817 0.341 . . . . 0.0 110.961 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 95.75 -3.39 65.21 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.523 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.446 ' CG ' ' O ' ' A' ' 99' ' ' ARG . 1.9 ttm180 -173.23 40.83 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.859 0.361 . . . . 0.0 110.94 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 0.445 ' O ' ' HB3' ' A' ' 101' ' ' ARG . . . -94.82 -79.85 1.47 Allowed Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.43 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.445 ' HB3' ' O ' ' A' ' 100' ' ' GLY . 0.0 OUTLIER 171.33 51.33 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.758 0.313 . . . . 0.0 110.9 179.992 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.743 HG21 ' OH ' ' A' ' 81' ' ' TYR . 3.5 mm -37.11 97.88 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.143 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.402 ' N ' ' O ' ' A' ' 101' ' ' ARG . 3.4 t -71.92 157.49 37.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.948 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 89.5 m -150.03 114.37 5.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.924 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . 0.468 ' O ' ' N ' ' A' ' 91' ' ' ASP . 8.8 t -129.63 154.27 47.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.19 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.758 HD11 ' CH2' ' A' ' 90' ' ' TRP . 2.9 mt -87.72 125.23 41.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.019 179.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -173.53 117.69 0.27 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.124 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -128.89 165.84 20.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.926 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 12.1 ttp180 . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.204 -0.903 . . . . 0.0 110.927 179.928 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.468 ' HB2' HD11 ' A' ' 30' ' ' ILE . 73.9 Cg_endo . . . . . 0 N--CA 1.463 -0.318 0 CA-C-O 120.739 0.224 . . . . 0.0 112.4 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 114.37 162.91 14.41 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.499 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 86.9 m -116.54 115.26 25.43 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.808 0.337 . . . . 0.0 110.863 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -91.26 114.35 26.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.951 -179.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -154.59 156.05 35.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.963 -179.906 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 46.1 t30 52.36 27.11 4.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.955 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 76.07 1.02 67.05 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.545 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 2.5 mptt -110.96 148.59 32.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.831 0.348 . . . . 0.0 110.939 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 4.5 t-160 -117.15 88.81 2.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.863 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -79.64 -175.19 4.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.96 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.506 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 10.6 tt0 -105.92 156.55 18.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.895 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.687 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.3 mp -52.8 156.59 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.34 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.422 ' N ' HG22 ' A' ' 30' ' ' ILE . 0.4 OUTLIER 59.42 14.22 3.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.981 179.866 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.506 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 21.1 tt0 -96.06 155.09 16.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.933 179.938 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 40.4 mt-30 -122.87 134.65 54.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.981 -179.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . 0.586 ' CZ2' ' HB3' ' A' ' 45' ' ' CYS . 23.4 p90 -136.01 175.07 9.93 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.964 179.827 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -100.37 127.6 46.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.036 -179.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.522 ' O ' ' CB ' ' A' ' 43' ' ' LEU . 17.5 tpt85 -128.31 162.75 26.33 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.643 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -140.54 129.96 23.93 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.562 -179.813 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.467 ' CD1' ' HB2' ' A' ' 39' ' ' LEU . 12.3 t80 -127.73 119.25 25.38 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.914 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.467 ' HB2' ' CD1' ' A' ' 38' ' ' TYR . 3.4 tp 76.26 13.29 2.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.722 -179.824 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 84.66 39.45 8.83 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.7 180.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.42 ' O ' ' C ' ' A' ' 42' ' ' ALA . 7.5 m-80 -141.67 125.52 17.06 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.734 0.302 . . . . 0.0 110.846 179.866 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.503 ' O ' HD12 ' A' ' 43' ' ' LEU . . . -35.55 147.77 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.946 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.522 ' CB ' ' O ' ' A' ' 36' ' ' ARG . 1.1 tp -159.28 150.7 20.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.224 -179.608 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.485 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 3.1 t -122.37 135.48 62.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.358 179.541 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.586 ' HB3' ' CZ2' ' A' ' 34' ' ' TRP . 0.7 OUTLIER -118.69 157.13 28.05 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.396 -179.429 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.434 ' O ' ' CE1' ' A' ' 48' ' ' TYR . 76.1 m -140.44 116.17 10.24 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.97 179.799 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.544 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 19.4 t -75.59 132.38 40.61 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.979 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.434 ' CE1' ' O ' ' A' ' 46' ' ' THR . 7.3 m-85 -105.52 -26.04 12.06 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.749 179.883 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.446 ' N ' HG23 ' A' ' 30' ' ' ILE . . . 87.02 163.24 38.63 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.551 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 58.79 -129.99 50.4 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.529 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -96.48 -13.06 23.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.848 0.356 . . . . 0.0 110.849 -179.918 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.409 ' HB3' ' CB ' ' A' ' 48' ' ' TYR . 0.4 OUTLIER -50.41 -33.49 20.95 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.96 -179.941 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 63.72 161.02 0.35 Allowed Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.785 -0.722 . . . . 0.0 112.537 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.574 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 4.0 p90 -91.45 161.36 15.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.859 0.361 . . . . 0.0 110.851 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -139.9 120.69 14.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.871 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.485 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.8 OUTLIER -90.95 168.2 11.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.938 -179.911 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -176.23 -178.23 0.96 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.978 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 17.3 m -80.09 160.01 25.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.91 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 3.1 mttt . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.804 179.915 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.447 -0.591 0 CA-C-O 120.823 0.344 . . . . 0.0 111.129 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.412 ' O ' ' O ' ' A' ' 65' ' ' THR . 0.1 OUTLIER -68.05 -166.89 0.07 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.911 179.959 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.412 ' O ' ' O ' ' A' ' 64' ' ' GLU . 6.2 p 46.45 -175.34 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.014 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.488 ' O ' HG23 ' A' ' 74' ' ' THR . 0.5 OUTLIER -160.91 -175.17 4.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.108 -179.877 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -130.08 143.54 50.85 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.836 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . 0.511 ' O ' ' N ' ' A' ' 72' ' ' GLY . 0.5 OUTLIER -117.3 81.75 1.7 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.914 -179.925 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 28.2 pttt -44.64 -33.54 1.85 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.834 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 4.1 m-30 -44.44 -61.3 1.58 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.809 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -134.03 27.31 3.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.978 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . 0.511 ' N ' ' O ' ' A' ' 68' ' ' ASP . . . 46.51 81.86 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.484 179.926 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . 0.568 ' HB3' ' CZ ' ' A' ' 75' ' ' TYR . 2.5 m120 -148.18 111.86 5.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.824 0.345 . . . . 0.0 110.961 -179.922 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.488 HG23 ' O ' ' A' ' 66' ' ' CYS . 18.7 m -80.21 125.97 30.52 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.954 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.568 ' CZ ' ' HB3' ' A' ' 73' ' ' ASN . 78.2 m-85 -121.26 175.78 5.96 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.634 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . 0.427 ' HB2' ' HB2' ' A' ' 79' ' ' ASP . 22.1 mtm180 -92.1 154.63 18.6 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.887 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.403 HG22 ' HA ' ' A' ' 97' ' ' ALA . 89.9 t -57.35 -63.32 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.127 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -83.4 51.59 4.6 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.474 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . 0.427 ' HB2' ' HB2' ' A' ' 76' ' ' ARG . 10.7 t0 -147.55 125.11 11.72 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.779 0.323 . . . . 0.0 110.92 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 44.6 p -86.23 150.24 24.52 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.068 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . 0.485 ' OH ' HG21 ' A' ' 102' ' ' ILE . 47.2 p90 -148.97 114.54 5.61 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.977 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.483 ' HG3' ' OD1' ' A' ' 91' ' ' ASP . 18.6 mt-10 -65.77 141.56 58.27 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.845 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.21 86.37 31.06 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.798 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 77.7 Cg_exo -49.93 96.8 0.03 OUTLIER 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.723 2.282 . . . . 0.0 112.354 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -121.33 136.5 54.96 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.984 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 53.2 -155.37 0.2 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.946 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 7.7 t -89.2 43.96 1.18 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.996 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . 0.555 ' O ' ' CD1' ' A' ' 90' ' ' TRP . 2.9 ttm -175.67 126.16 0.23 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.952 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 9.1 mt -87.03 128.71 39.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.037 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' TRP . . . . . 0.575 ' CZ3' HD11 ' A' ' 106' ' ' ILE . 1.2 m95 -119.92 120.45 36.42 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.912 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.483 ' OD1' ' HG3' ' A' ' 82' ' ' GLU . 0.2 OUTLIER -60.58 87.85 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.844 179.94 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 25.4 m -67.77 123.36 20.3 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.985 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.41 ' O ' ' HA ' ' A' ' 102' ' ' ILE . 82.5 m -112.23 136.45 51.63 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.914 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 44.2 t -70.08 62.58 0.21 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.053 -179.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.488 ' HB ' ' O ' ' A' ' 101' ' ' ARG . 2.7 mt -71.4 96.48 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.087 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.52 ' O ' ' N ' ' A' ' 98' ' ' GLY . . . 123.85 103.98 1.61 Allowed Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.363 -179.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.403 ' HA ' HG22 ' A' ' 77' ' ' VAL . . . -49.29 85.28 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.795 0.331 . . . . 0.0 111.356 -179.741 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . 0.52 ' N ' ' O ' ' A' ' 96' ' ' GLY . . . 119.24 10.98 7.7 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.603 -0.808 . . . . 0.0 113.004 179.693 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.498 ' HB3' ' O ' ' A' ' 98' ' ' GLY . 0.1 OUTLIER 83.29 107.91 0.06 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.922 0.392 . . . . 0.0 110.838 -179.982 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 0.471 ' O ' ' HG3' ' A' ' 101' ' ' ARG . . . -150.11 -38.46 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.393 179.86 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.488 ' O ' ' HB ' ' A' ' 95' ' ' ILE . 0.7 OUTLIER -146.02 38.58 1.09 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.71 0.291 . . . . 0.0 111.041 179.913 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.485 HG21 ' OH ' ' A' ' 81' ' ' TYR . 17.6 mt -47.59 90.69 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.18 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.462 ' N ' ' O ' ' A' ' 101' ' ' ARG . 0.2 OUTLIER -87.24 149.33 24.66 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.916 179.926 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 3.6 m -134.6 109.22 8.51 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.921 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -106.27 143.2 34.74 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.088 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.575 HD11 ' CZ3' ' A' ' 90' ' ' TRP . 2.5 mp -66.48 94.34 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.117 179.938 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -128.32 113.13 15.23 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.152 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . 0.405 ' O ' ' HB3' ' A' ' 109' ' ' ARG . 21.9 t-20 -175.4 68.16 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.958 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . 0.405 ' HB3' ' O ' ' A' ' 108' ' ' ASN . 4.6 ptp180 . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.899 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo . . . . . 0 C--O 1.231 0.159 0 CA-C-O 120.778 0.241 . . . . 0.0 112.274 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 142.21 -171.88 24.43 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.55 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -159.99 110.42 1.88 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.817 0.341 . . . . 0.0 110.92 -179.94 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -90.05 140.49 29.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.916 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.451 ' OD1' ' O ' ' A' ' 26' ' ' LYS . 1.1 p-10 -126.98 -160.95 1.03 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.848 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.432 ' C ' ' O ' ' A' ' 23' ' ' ASP . 0.7 OUTLIER -34.87 -52.25 0.53 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.009 -0.542 . . . . 0.0 111.068 -179.882 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -163.5 22.81 0.18 Allowed Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.62 180.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.53 ' CE ' ' HA ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -128.95 144.82 51.3 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.798 0.332 . . . . 0.0 110.969 179.797 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 4.2 t-160 -119.66 85.42 2.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.302 -179.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.526 ' CE2' ' CG ' ' A' ' 34' ' ' TRP . 96.6 m-85 -85.01 166.3 16.83 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.833 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.514 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 0.0 OUTLIER -91.86 149.4 21.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.608 179.705 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.66 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.8 mp -41.58 147.14 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 120.851 0.357 . . . . 0.0 111.191 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.476 ' HB2' ' O ' ' A' ' 30' ' ' ILE . 70.4 m-20 67.17 11.47 8.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.301 179.813 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.514 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 10.2 tp60 -99.24 145.06 27.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.799 0.333 . . . . 0.0 110.613 179.66 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -112.63 156.51 22.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.173 -179.714 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . 0.571 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 48.9 p90 -160.87 173.99 14.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.887 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.455 ' HG3' ' O ' ' A' ' 43' ' ' LEU . 0.1 OUTLIER -99.92 141.78 32.29 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.113 -179.823 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.52 ' O ' ' N ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -140.36 169.81 16.98 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.724 179.886 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -137.45 125.76 23.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.769 -179.762 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.42 ' HB2' HD22 ' A' ' 43' ' ' LEU . 6.1 t80 -119.6 136.84 54.2 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.681 179.718 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.516 ' HA ' HD12 ' A' ' 39' ' ' LEU . 2.4 tp 64.24 13.1 7.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.693 -179.77 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 85.71 29.65 26.03 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.933 -0.651 . . . . 0.0 112.743 179.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -133.39 145.67 50.54 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.784 0.326 . . . . 0.0 111.027 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -43.75 151.29 0.21 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.64 179.768 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.52 ' N ' ' O ' ' A' ' 36' ' ' ARG . 4.4 tp -170.24 165.59 8.96 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.951 0.405 . . . . 0.0 111.379 -179.615 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.494 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 17.7 t -132.31 151.97 35.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.398 179.459 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.571 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 0.5 OUTLIER -129.26 153.56 47.67 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.903 0.382 . . . . 0.0 111.423 -179.564 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 69.4 m -138.4 131.96 30.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.757 179.715 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.498 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 21.0 t -92.86 161.5 14.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.042 -179.728 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.516 ' O ' ' CG2' ' A' ' 30' ' ' ILE . 36.8 m-85 -138.62 -43.99 0.49 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.771 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 104.2 167.67 24.89 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.469 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 65.95 -113.38 5.7 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.613 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -104.29 -24.65 13.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.783 0.325 . . . . 0.0 110.992 -179.875 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.483 ' HB3' ' HB2' ' A' ' 48' ' ' TYR . 0.1 OUTLIER -54.99 -36.33 65.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.847 -179.952 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 63.48 -103.89 0.75 Allowed Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.549 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.552 ' CE1' ' SG ' ' A' ' 45' ' ' CYS . 1.4 p90 -158.58 166.69 31.51 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.854 0.359 . . . . 0.0 111.002 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -149.07 112.23 4.92 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.658 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.494 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.6 OUTLIER -83.4 170.93 13.99 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.121 -179.752 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 171.99 178.78 0.07 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.965 -179.879 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.3 p -59.36 173.42 0.51 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.018 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.045 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 . . . . . 0 N--CA 1.455 -0.198 0 CA-C-O 120.865 0.364 . . . . 0.0 110.575 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.5 ' HG2' ' HG2' ' A' ' 76' ' ' ARG . 0.0 OUTLIER -92.01 117.18 29.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.894 -179.919 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -171.23 163.94 7.18 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.239 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 175.86 171.65 0.36 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.876 -180.0 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -179.28 94.0 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.963 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . 0.583 ' HB2' ' CE2' ' A' ' 75' ' ' TYR . 38.7 t0 -69.02 81.65 0.31 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.731 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 7.3 pttm -41.75 -31.31 0.29 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.907 -179.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 8.0 m-30 -51.64 -27.36 11.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.759 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 24.0 p -137.7 -54.47 0.67 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.087 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 126.98 4.06 6.14 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.56 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . 0.528 ' HB3' ' CE1' ' A' ' 75' ' ' TYR . 2.2 m120 -70.95 149.29 46.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.835 0.35 . . . . 0.0 110.943 -179.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 91.7 m -103.54 117.11 33.69 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.992 179.839 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.583 ' CE2' ' HB2' ' A' ' 68' ' ' ASP . 6.5 m-85 -105.79 -160.51 0.75 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.806 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . 0.5 ' HG2' ' HG2' ' A' ' 64' ' ' GLU . 0.0 OUTLIER -142.05 133.35 26.4 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.721 179.839 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 55.0 t -49.97 -26.21 2.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.166 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -89.12 21.79 26.07 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.418 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -145.95 135.05 22.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.801 0.334 . . . . 0.0 111.083 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 3.2 p -107.2 171.92 7.11 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.176 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 49.0 p90 -165.28 150.11 9.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.869 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -87.47 133.31 33.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.08 -179.848 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 20.3 ttp180 -132.95 73.02 76.21 Favored Pre-proline 0 C--N 1.327 -0.385 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.708 179.712 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_exo -46.5 152.34 1.54 Allowed 'Trans proline' 0 C--N 1.342 0.219 0 C-N-CA 122.797 2.332 . . . . 0.0 112.589 -179.862 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 5.7 tptp -178.77 160.34 1.15 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.822 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 54.03 35.6 22.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.921 -179.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.9 m 60.8 48.17 7.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.868 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -169.68 160.51 8.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.823 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 2.5 mp -100.12 133.66 42.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.983 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' TRP . . . . . 0.524 ' CD1' ' N ' ' A' ' 90' ' ' TRP . 1.4 m95 -134.77 112.78 11.02 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.93 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -68.36 80.99 0.25 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.917 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . 0.435 ' HA ' ' HA ' ' A' ' 104' ' ' CYS . 0.6 OUTLIER -54.85 178.79 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.896 179.938 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 97.5 m -157.23 131.2 8.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.095 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 9.2 t -72.25 74.71 0.98 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 -179.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.819 HG22 ' CA ' ' A' ' 100' ' ' GLY . 1.0 OUTLIER -78.77 115.64 21.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.369 -179.94 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -149.45 97.5 0.18 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.512 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -159.59 61.26 0.38 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.859 0.361 . . . . 0.0 110.994 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . 0.489 ' O ' ' CB ' ' A' ' 99' ' ' ARG . . . 72.28 8.94 71.66 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.54 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.489 ' CB ' ' O ' ' A' ' 98' ' ' GLY . 0.0 OUTLIER 161.24 45.56 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.904 0.383 . . . . 0.0 111.012 -179.985 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 0.819 ' CA ' HG22 ' A' ' 95' ' ' ILE . . . -89.58 -52.61 2.62 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.386 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.484 ' CD ' ' O ' ' A' ' 100' ' ' GLY . 0.0 OUTLIER 48.56 105.7 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.816 0.341 . . . . 0.0 111.107 179.926 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.42 ' C ' ' O ' ' A' ' 101' ' ' ARG . 3.6 mp -36.92 130.82 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.922 179.755 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.41 ' O ' ' HA ' ' A' ' 92' ' ' CYS . 13.2 t -127.66 159.96 33.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.047 -179.785 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.435 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 0.5 OUTLIER -134.15 127.45 32.07 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.801 179.94 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . 0.542 ' O ' HG23 ' A' ' 105' ' ' THR . 4.8 t -148.15 121.15 8.81 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.271 -179.86 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.464 HD11 ' CH2' ' A' ' 90' ' ' TRP . 2.7 mt -44.15 151.06 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.056 179.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -88.15 122.81 32.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.14 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -60.4 145.8 46.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.969 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 2.9 ttp180 . . . . . 0 C--O 1.25 1.088 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.893 179.984 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo . . . . . 0 N--CA 1.465 -0.172 0 CA-C-O 120.842 0.268 . . . . 0.0 112.12 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . 0.463 ' CA ' HD11 ' A' ' 30' ' ' ILE . . . 101.45 137.62 9.81 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.474 -179.911 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.423 ' O ' ' CD2' ' A' ' 27' ' ' HIS . 2.0 m -84.23 151.25 24.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.781 0.324 . . . . 0.0 110.854 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 82.7 t80 -157.61 109.95 2.39 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.907 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.462 ' OD1' ' N ' ' A' ' 24' ' ' ASN . 38.8 t0 -151.48 157.85 42.86 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.923 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.462 ' N ' ' OD1' ' A' ' 23' ' ' ASP . 4.5 t-20 56.54 26.43 11.0 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.932 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 76.17 7.35 84.49 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.465 179.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.439 ' HB3' ' CE2' ' A' ' 28' ' ' TYR . 0.1 OUTLIER -116.02 141.38 48.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.856 0.36 . . . . 0.0 110.897 179.946 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . 0.423 ' CD2' ' O ' ' A' ' 21' ' ' CYS . 3.3 t-160 -113.58 89.29 3.05 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.041 -179.911 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.439 ' CE2' ' HB3' ' A' ' 26' ' ' LYS . 94.8 m-85 -87.17 145.19 26.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.806 179.899 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.511 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 10.4 tt0 -62.97 151.68 38.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.091 179.629 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.528 HD12 ' HA2' ' A' ' 49' ' ' GLY . 19.8 mm -50.56 144.28 2.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.935 0.397 . . . . 0.0 110.827 -179.779 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.475 ' HB2' ' O ' ' A' ' 30' ' ' ILE . 5.4 m-20 71.23 3.74 4.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.121 -179.808 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.511 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 29.7 tp60 -80.01 151.14 30.14 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.709 179.582 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.41 ' CG ' HG23 ' A' ' 46' ' ' THR . 25.2 mt-30 -115.37 142.78 46.23 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.783 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . 0.425 ' CZ3' ' HB2' ' A' ' 47' ' ' CYS . 40.6 p90 -145.45 171.3 14.84 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.943 0.401 . . . . 0.0 111.072 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 13.8 tm-20 -100.66 140.28 35.16 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.227 -179.763 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -137.18 -167.89 2.19 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.362 179.714 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.559 ' CG2' ' N ' ' A' ' 38' ' ' TYR . 1.8 t -151.2 -51.77 0.13 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.679 0.276 . . . . 0.0 111.55 179.791 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.559 ' N ' ' CG2' ' A' ' 37' ' ' THR . 18.4 t80 44.86 104.97 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.267 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.486 ' CB ' ' O ' ' A' ' 38' ' ' TYR . 1.7 tp 82.77 15.56 0.37 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.779 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 66.13 51.68 42.65 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.81 -0.709 . . . . 0.0 112.717 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.473 ' O ' ' HA ' ' A' ' 37' ' ' THR . 62.2 m-80 -150.95 129.28 12.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.609 0.242 . . . . 0.0 110.983 179.866 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.434 ' O ' ' HA ' ' A' ' 58' ' ' SER . . . -32.96 119.43 0.32 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.032 179.964 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.698 HD12 ' C ' ' A' ' 57' ' ' GLU . 15.0 tp -145.13 146.19 31.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.208 -179.529 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.488 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 4.1 t -130.62 139.07 52.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.551 179.659 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.517 ' SG ' ' CD1' ' A' ' 54' ' ' PHE . 0.4 OUTLIER -123.84 150.45 44.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.291 -179.626 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.545 ' O ' ' CE1' ' A' ' 48' ' ' TYR . 24.1 m -134.74 118.64 17.31 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.85 179.803 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.469 ' SG ' ' HA ' ' A' ' 30' ' ' ILE . 38.1 t -71.01 152.96 43.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.977 0.418 . . . . 0.0 110.932 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.545 ' CE1' ' O ' ' A' ' 46' ' ' THR . 5.3 m-85 -125.78 -31.26 2.94 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.133 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.528 ' HA2' HD12 ' A' ' 30' ' ' ILE . . . 89.55 179.01 45.14 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.5 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 52.73 -113.63 2.91 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.469 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 5.9 m -111.33 -23.74 10.62 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.818 0.342 . . . . 0.0 110.939 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.499 ' HB2' ' HB2' ' A' ' 48' ' ' TYR . 55.8 mtm180 -50.76 -39.42 52.3 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.873 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . 0.445 ' O ' ' N ' ' A' ' 48' ' ' TYR . . . 70.53 -131.84 22.16 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.665 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.517 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 3.6 p90 -146.97 162.65 38.31 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.876 0.369 . . . . 0.0 110.961 -179.873 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.471 ' HB3' ' OH ' ' A' ' 48' ' ' TYR . 2.2 t30 -143.06 126.43 16.67 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.696 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.503 ' HB3' HD21 ' A' ' 43' ' ' LEU . 2.0 m -87.19 166.66 14.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.101 -179.864 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.698 ' C ' HD12 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -171.32 135.58 0.96 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.901 -179.934 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.532 ' N ' HD12 ' A' ' 43' ' ' LEU . 0.1 OUTLIER -50.01 140.17 12.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.053 -179.99 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.783 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 . . . . . 0 N--CA 1.455 -0.216 0 CA-C-O 120.797 0.332 . . . . 0.0 110.614 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.451 ' O ' ' O ' ' A' ' 65' ' ' THR . 0.0 OUTLIER -176.97 161.34 1.93 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.033 -179.969 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.472 ' O ' ' HA ' ' A' ' 97' ' ' ALA . 2.8 p 46.14 -177.84 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.308 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 24.7 p -175.14 162.7 3.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.788 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.504 ' CB ' ' HA2' ' A' ' 98' ' ' GLY . 82.3 t80 -117.97 126.24 51.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.042 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -82.05 105.22 12.97 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.748 179.83 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.64 -1.21 17.96 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.162 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 3.8 m-30 -94.32 -25.13 17.13 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.843 0.354 . . . . 0.0 110.862 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 1.1 p -142.45 -47.96 0.34 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.226 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 113.75 39.99 1.04 Allowed Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.454 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . 0.492 ' HB3' ' CZ ' ' A' ' 75' ' ' TYR . 0.8 OUTLIER -113.1 120.28 40.76 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.803 0.335 . . . . 0.0 110.788 -179.968 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 41.7 m -69.28 128.51 36.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.013 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.492 ' CZ ' ' HB3' ' A' ' 73' ' ' ASN . 62.1 m-85 -130.97 -171.6 2.61 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.788 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 23.0 mtp85 -103.49 134.8 46.24 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.736 179.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 9.0 p -57.46 -22.98 18.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.138 -179.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -92.52 23.48 27.73 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.486 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -142.64 128.19 19.07 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.882 0.372 . . . . 0.0 110.886 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.491 ' OG1' ' N ' ' A' ' 81' ' ' TYR . 0.1 OUTLIER -101.29 176.1 5.36 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.061 179.993 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . 0.811 ' OH ' HG21 ' A' ' 102' ' ' ILE . 33.8 p90 -154.41 138.25 16.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.861 -179.873 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.406 ' HA ' ' HA ' ' A' ' 91' ' ' ASP . 4.4 mt-10 -69.96 136.57 50.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.006 0.432 . . . . 0.0 110.857 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.442 ' HD3' ' HA ' ' A' ' 83' ' ' ARG . 0.0 OUTLIER -154.14 93.83 2.9 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.83 -179.935 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -66.82 166.74 21.5 Favored 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.737 2.292 . . . . 0.0 112.282 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 178.45 158.73 0.51 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.888 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 38.7 t0 59.28 -89.71 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.861 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 10.4 p -156.34 25.37 0.35 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.942 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . 0.448 ' O ' ' CD1' ' A' ' 90' ' ' TRP . 0.0 OUTLIER -154.15 152.61 30.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.985 -179.926 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 7.9 mt -92.07 130.6 40.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.054 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' TRP . . . . . 0.573 ' CE3' HG13 ' A' ' 106' ' ' ILE . 0.8 OUTLIER -128.38 129.93 46.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.883 -179.944 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.406 ' HA ' ' HA ' ' A' ' 82' ' ' GLU . 0.7 OUTLIER -83.49 69.91 10.14 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.923 179.925 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . 0.461 ' HA ' ' O ' ' A' ' 103' ' ' SER . 0.8 OUTLIER -44.2 127.19 5.49 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.03 -179.954 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.507 ' O ' ' N ' ' A' ' 95' ' ' ILE . 6.0 m -105.59 120.64 42.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.985 179.815 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.835 ' HA ' HG23 ' A' ' 102' ' ' ILE . 0.1 OUTLIER -58.38 77.63 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.949 -179.859 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.507 ' N ' ' O ' ' A' ' 93' ' ' THR . 1.8 mt -89.87 131.59 36.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.259 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 115.38 -142.29 17.51 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.539 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.472 ' HA ' ' O ' ' A' ' 65' ' ' THR . . . -163.27 43.76 0.11 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.864 0.364 . . . . 0.0 110.939 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . 0.504 ' HA2' ' CB ' ' A' ' 67' ' ' PHE . . . 93.43 12.6 57.0 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.537 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -167.77 38.05 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.818 0.342 . . . . 0.0 111.01 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 0.408 ' O ' ' HB3' ' A' ' 101' ' ' ARG . . . -118.96 -91.67 1.4 Allowed Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.491 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.408 ' HB3' ' O ' ' A' ' 100' ' ' GLY . 0.0 OUTLIER 168.49 109.67 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.867 0.365 . . . . 0.0 110.875 -179.969 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.835 HG23 ' HA ' ' A' ' 94' ' ' CYS . 1.2 mm -69.69 74.64 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.153 -179.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.461 ' O ' ' HA ' ' A' ' 92' ' ' CYS . 13.4 t -41.99 156.56 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.893 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.47 ' SG ' ' HB2' ' A' ' 90' ' ' TRP . 0.0 OUTLIER -138.7 97.25 3.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.902 -179.943 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 4.5 t -103.88 135.57 45.16 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.158 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.573 HG13 ' CE3' ' A' ' 90' ' ' TRP . 2.5 mp -48.99 145.07 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.011 179.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -71.35 98.43 1.77 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.086 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -137.2 136.37 38.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.909 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 5.5 mtt-85 . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.18 -0.914 . . . . 0.0 110.889 179.91 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo . . . . . 0 N--CA 1.464 -0.209 0 CA-C-O 120.856 0.273 . . . . 0.0 112.271 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . 0.57 ' N ' HD11 ' A' ' 30' ' ' ILE . . . 106.77 -164.05 13.36 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.538 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.517 ' O ' ' CD2' ' A' ' 27' ' ' HIS . 0.2 OUTLIER -155.45 155.49 33.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.794 0.33 . . . . 0.0 110.845 -179.972 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -142.65 130.59 21.75 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.817 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.41 ' O ' ' N ' ' A' ' 26' ' ' LYS . 1.4 t0 -161.73 144.25 11.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.136 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.423 ' ND2' ' HE2' ' A' ' 26' ' ' LYS . 0.8 OUTLIER 44.81 28.79 0.38 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.232 179.782 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 85.25 -10.34 63.99 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.762 179.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.423 ' HE2' ' ND2' ' A' ' 24' ' ' ASN . 0.9 OUTLIER -89.85 140.37 29.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.872 0.367 . . . . 0.0 110.787 179.979 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . 0.517 ' CD2' ' O ' ' A' ' 21' ' ' CYS . 14.9 t-80 -120.1 92.34 3.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.257 -179.757 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.434 ' CE2' ' CD1' ' A' ' 34' ' ' TRP . 0.1 OUTLIER -83.43 165.24 19.38 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.765 179.713 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.526 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 8.7 tt0 -94.9 145.19 25.08 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.837 179.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.702 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.7 mp -48.91 150.81 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.349 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 78.8 m-20 59.84 17.24 6.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.125 179.74 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.526 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 1.1 tt0 -102.88 154.35 19.29 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.838 0.351 . . . . 0.0 110.934 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -120.32 138.71 53.55 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.901 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . 0.555 ' CZ3' ' HB2' ' A' ' 47' ' ' CYS . 31.3 p90 -146.36 -176.93 5.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.871 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -108.79 123.46 49.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.024 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.518 ' O ' ' CB ' ' A' ' 43' ' ' LEU . 0.5 OUTLIER -131.75 167.6 19.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.603 179.766 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.477 ' HG1' ' C ' ' A' ' 41' ' ' ASN . 1.6 t -134.23 137.11 44.11 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.919 179.836 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.488 ' O ' ' CB ' ' A' ' 39' ' ' LEU . 22.1 t80 -107.74 108.54 19.81 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.874 -179.837 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.488 ' CB ' ' O ' ' A' ' 38' ' ' TYR . 6.7 tp 82.36 -49.24 0.19 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.821 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 165.16 36.94 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.795 -0.716 . . . . 0.0 112.51 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.477 ' C ' ' HG1' ' A' ' 37' ' ' THR . 68.9 m-80 -141.08 128.78 21.55 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 120.735 0.303 . . . . 0.0 111.053 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.478 ' O ' ' CD1' ' A' ' 43' ' ' LEU . . . -36.16 150.94 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.908 179.856 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.518 ' CB ' ' O ' ' A' ' 36' ' ' ARG . 1.4 tp -167.64 153.6 7.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.906 0.384 . . . . 0.0 111.275 -179.734 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.505 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.3 t -119.81 123.03 70.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.192 179.35 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.515 ' HB2' ' CE2' ' A' ' 34' ' ' TRP . 85.2 m -104.15 159.1 15.97 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.636 -179.141 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.473 ' O ' ' CE1' ' A' ' 48' ' ' TYR . 6.6 m -140.36 116.6 10.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.712 179.639 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.555 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 6.4 t -82.33 133.7 35.24 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.228 -179.569 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.473 ' CE1' ' O ' ' A' ' 46' ' ' THR . 7.1 m-85 -117.38 -27.08 6.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.629 179.864 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 138.67 174.14 13.31 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.227 -179.807 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -75.34 64.62 2.45 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.439 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -173.02 -64.29 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.792 0.33 . . . . 0.0 111.003 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -67.39 -24.95 65.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.242 -179.773 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 70.97 134.79 0.11 Allowed Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.216 -179.746 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.57 ' CD1' ' O ' ' A' ' 54' ' ' PHE . 4.8 p90 -69.98 132.66 46.26 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.942 0.401 . . . . 0.0 111.304 -179.692 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -108.39 140.54 41.53 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.237 179.542 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.505 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 2.4 m -126.63 176.01 7.53 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.992 0.425 . . . . 0.0 111.491 -179.529 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 177.52 -171.57 0.1 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.73 -179.912 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -56.9 141.71 44.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.952 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.965 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.455 -0.219 0 CA-C-O 120.88 0.372 . . . . 0.0 110.573 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 171.49 176.4 0.07 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.999 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 17.5 p 60.86 -177.65 0.11 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.224 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 20.2 t 176.2 129.17 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.854 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.547 ' CE1' ' HA ' ' A' ' 69' ' ' LYS . 53.2 t80 -85.39 108.07 17.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.007 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . 0.464 ' O ' ' O ' ' A' ' 69' ' ' LYS . 1.2 t70 -81.34 85.75 6.37 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.737 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.547 ' HA ' ' CE1' ' A' ' 67' ' ' PHE . 0.3 OUTLIER -39.81 164.46 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.905 -179.941 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . 0.503 ' CD1' ' N ' ' A' ' 70' ' ' TYR . 2.0 m-30 83.95 -46.31 0.11 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.892 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -111.87 -42.04 3.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.131 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . 0.443 ' HA2' ' CE2' ' A' ' 67' ' ' PHE . . . 90.34 5.62 69.58 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.554 -179.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 65.9 m-80 -74.01 105.82 5.42 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.845 0.355 . . . . 0.0 110.906 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 26.5 m -54.43 118.03 3.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.013 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.486 ' CE2' ' HB3' ' A' ' 81' ' ' TYR . 17.2 m-30 -110.05 177.58 4.67 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.696 179.894 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . 0.476 ' HB2' ' HB2' ' A' ' 79' ' ' ASP . 0.6 OUTLIER -104.37 141.62 36.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.871 179.969 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.463 ' HA ' ' O ' ' A' ' 94' ' ' CYS . 9.0 p -47.8 -29.43 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.138 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -105.8 14.39 45.57 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.499 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . 0.476 ' HB2' ' HB2' ' A' ' 76' ' ' ARG . 8.9 t70 -112.23 110.92 21.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.896 0.379 . . . . 0.0 110.887 -179.913 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.509 HG22 ' OG1' ' A' ' 93' ' ' THR . 2.7 p -81.89 150.46 27.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.158 179.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . 0.537 ' OH ' HG21 ' A' ' 102' ' ' ILE . 11.6 p90 -123.17 -33.08 3.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.946 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.469 ' HB3' ' O ' ' A' ' 81' ' ' TYR . 30.7 tt0 76.44 165.75 0.25 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.92 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.4 ' HA ' ' HD2' ' A' ' 84' ' ' PRO . 0.2 OUTLIER -172.39 107.57 0.35 Allowed Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.742 179.964 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.401 ' HA ' ' HA ' ' A' ' 89' ' ' ILE . 49.4 Cg_endo -68.94 89.6 0.44 Allowed 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.716 2.277 . . . . 0.0 112.352 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 10.3 mttt -111.54 137.06 49.87 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.919 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 68.24 9.01 6.96 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.004 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.0 p 69.97 13.19 7.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.947 179.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . 0.417 ' HB3' ' NE1' ' A' ' 90' ' ' TRP . 0.0 OUTLIER -102.1 -23.32 14.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.96 -179.933 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.405 ' O ' ' O ' ' A' ' 88' ' ' MET . 2.9 mp 59.31 122.29 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.12 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' TRP . . . . . 0.563 ' CH2' HD11 ' A' ' 106' ' ' ILE . 4.5 m95 -131.94 109.74 10.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.959 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -57.77 79.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.663 179.82 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . 0.702 ' SG ' HG22 ' A' ' 102' ' ' ILE . 0.5 OUTLIER -82.65 152.51 25.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.069 -179.782 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.509 ' OG1' HG22 ' A' ' 80' ' ' THR . 25.9 m -125.71 126.73 45.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.974 179.841 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.608 ' HA ' HD12 ' A' ' 102' ' ' ILE . 0.3 OUTLIER -57.83 80.11 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.024 -179.896 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.488 HG13 ' O ' ' A' ' 93' ' ' THR . 0.9 OUTLIER -97.57 141.43 15.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.199 179.975 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.432 ' HA3' ' HA3' ' A' ' 100' ' ' GLY . . . 127.36 162.74 11.23 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.436 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -96.94 57.92 1.55 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.78 0.324 . . . . 0.0 111.101 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . 0.48 ' O ' ' CB ' ' A' ' 99' ' ' ARG . . . 92.72 7.99 62.52 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.506 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.48 ' CB ' ' O ' ' A' ' 98' ' ' GLY . 0.0 OUTLIER 162.21 38.88 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.88 0.371 . . . . 0.0 110.836 -179.92 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 0.432 ' HA3' ' HA3' ' A' ' 96' ' ' GLY . . . -76.8 -86.96 0.37 Allowed Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.491 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.558 ' N ' ' CD ' ' A' ' 101' ' ' ARG . 0.0 OUTLIER -176.12 94.91 0.06 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.831 0.348 . . . . 0.0 110.996 179.875 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.702 HG22 ' SG ' ' A' ' 92' ' ' CYS . 2.4 mm -58.59 99.43 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.951 179.734 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.416 ' C ' ' SG ' ' A' ' 92' ' ' CYS . 1.4 t -73.06 125.51 27.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.128 -179.82 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.472 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 59.2 m -108.32 164.17 12.55 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.834 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 3.2 t -178.27 149.45 0.53 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.181 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.563 HD11 ' CH2' ' A' ' 90' ' ' TRP . 5.0 mt -82.41 137.79 20.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.078 179.843 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -158.18 150.47 22.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.133 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . 0.482 ' O ' ' CB ' ' A' ' 109' ' ' ARG . 8.7 t30 179.49 59.29 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.918 -179.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . 0.482 ' CB ' ' O ' ' A' ' 108' ' ' ASN . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.244 -0.884 . . . . 0.0 110.887 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.48 ' O ' HG13 ' A' ' 30' ' ' ILE . 35.1 Cg_exo . . . . . 0 C--O 1.231 0.164 0 CA-C-O 120.894 0.289 . . . . 0.0 112.33 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . 0.469 ' HA2' HG13 ' A' ' 30' ' ' ILE . . . -70.73 -148.78 0.5 Allowed Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.443 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 81.0 m -134.83 93.76 3.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.912 0.387 . . . . 0.0 110.956 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -47.91 147.89 1.85 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.023 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.43 ' O ' ' CG ' ' A' ' 24' ' ' ASN . 14.2 t0 -178.3 131.85 0.14 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.767 179.977 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.43 ' CG ' ' O ' ' A' ' 23' ' ' ASP . 10.1 p30 51.04 22.92 1.34 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.989 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 88.64 -10.18 73.1 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.508 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.418 ' HB3' ' CZ ' ' A' ' 28' ' ' TYR . 0.1 OUTLIER -92.56 131.29 37.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.795 0.331 . . . . 0.0 110.835 179.963 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 14.7 t-160 -113.87 91.08 3.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.145 -179.704 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.469 ' O ' ' HA3' ' A' ' 20' ' ' GLY . 0.5 OUTLIER -79.76 176.9 9.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.802 179.837 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.529 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 0.0 OUTLIER -91.11 148.11 22.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.953 -179.946 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.692 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.7 mp -48.07 148.76 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.298 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 11.6 m-20 62.79 15.54 8.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.197 179.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.529 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 15.1 tt0 -98.14 150.36 21.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.804 0.335 . . . . 0.0 110.727 179.864 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.968 ' HG2' HG23 ' A' ' 46' ' ' THR . 8.8 mt-30 -110.21 156.17 21.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.086 -179.737 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . 0.584 ' CH2' ' O ' ' A' ' 46' ' ' THR . 48.6 p90 -162.56 -170.9 2.55 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.76 179.603 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -112.39 132.82 54.81 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.41 -179.581 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.521 ' O ' ' N ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -134.17 -174.1 3.45 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.22 179.548 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.444 ' HG1' ' C ' ' A' ' 41' ' ' ASN . 1.7 t -145.53 134.93 23.1 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.963 0.411 . . . . 0.0 111.312 179.942 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.462 ' CB ' HD22 ' A' ' 43' ' ' LEU . 1.6 t80 -128.95 122.75 30.85 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.597 179.696 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.443 ' CB ' ' O ' ' A' ' 38' ' ' TYR . 1.5 tp 78.85 8.71 1.96 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.663 -179.595 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 89.12 41.59 5.82 Favored Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.995 -0.622 . . . . 0.0 112.754 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.444 ' C ' ' HG1' ' A' ' 37' ' ' THR . 65.2 m-80 -152.14 136.85 17.01 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.681 0.277 . . . . 0.0 111.069 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.43 ' C ' ' O ' ' A' ' 41' ' ' ASN . . . -37.08 152.25 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.643 179.659 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.521 ' N ' ' O ' ' A' ' 36' ' ' ARG . 2.6 tp -167.15 156.56 10.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.02 0.438 . . . . 0.0 111.535 -179.537 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.505 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 15.2 t -110.09 155.54 11.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.693 178.927 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.574 ' SG ' ' CD1' ' A' ' 54' ' ' PHE . 0.1 OUTLIER -161.22 174.02 14.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.112 0.482 . . . . 0.0 111.6 -179.502 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.968 HG23 ' HG2' ' A' ' 33' ' ' GLN . 0.2 OUTLIER -138.79 -167.58 2.24 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.746 179.878 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.523 ' H ' HG22 ' A' ' 46' ' ' THR . 46.4 t -134.82 140.45 45.86 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.94 0.4 . . . . 0.0 111.019 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -110.54 -36.94 5.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.776 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.478 ' O ' ' N ' ' A' ' 51' ' ' SER . . . 127.18 163.66 11.49 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.406 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . 0.42 ' C ' ' O ' ' A' ' 49' ' ' GLY . . . 36.1 29.86 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.693 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . 0.478 ' N ' ' O ' ' A' ' 49' ' ' GLY . 0.1 OUTLIER 49.65 35.24 8.35 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.86 0.362 . . . . 0.0 111.006 179.935 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.46 ' HG3' ' O ' ' A' ' 49' ' ' GLY . 9.7 mtp85 -58.83 -51.91 67.97 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.723 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 156.83 89.75 0.07 OUTLIER Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.613 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.574 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 1.8 p90 -58.17 -172.03 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.836 0.35 . . . . 0.0 110.813 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -136.13 114.09 11.29 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.76 179.89 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.505 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 13.3 m -94.61 -178.64 4.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.01 -179.855 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.504 ' O ' HD11 ' A' ' 43' ' ' LEU . 0.1 OUTLIER -171.95 -92.29 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.023 -179.996 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.485 ' HA ' ' HA ' ' A' ' 43' ' ' LEU . 0.2 OUTLIER 175.81 -177.16 0.12 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.914 -179.91 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 1.3 mmmt . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.915 -179.935 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.232 0.174 0 CA-C-O 120.799 0.333 . . . . 0.0 110.635 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.457 ' HG2' ' O ' ' A' ' 64' ' ' GLU . 17.4 tt0 -177.29 39.54 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.889 179.969 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.406 ' C ' ' SG ' ' A' ' 66' ' ' CYS . 7.1 p -146.7 -166.16 2.42 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.129 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.473 ' O ' ' HB3' ' A' ' 67' ' ' PHE . 0.0 OUTLIER -157.02 -63.66 0.1 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.888 -179.934 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.473 ' HB3' ' O ' ' A' ' 66' ' ' CYS . 24.3 t80 79.76 92.25 0.05 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.806 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . 0.89 ' OD1' HD13 ' A' ' 102' ' ' ILE . 0.6 OUTLIER -88.69 44.4 1.2 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.988 -179.96 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.606 ' HG3' ' CD1' ' A' ' 70' ' ' TYR . 2.2 ptmt 36.16 -144.52 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.728 179.836 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . 0.606 ' CD1' ' HG3' ' A' ' 69' ' ' LYS . 9.4 m-30 79.95 -50.33 0.37 Allowed 'General case' 0 C--O 1.231 0.129 0 CA-C-O 120.722 0.296 . . . . 0.0 110.854 -179.687 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 5.3 t -171.37 -35.88 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.26 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 141.41 55.88 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.554 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 24.0 m-80 -104.44 49.53 0.81 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.738 0.304 . . . . 0.0 110.963 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.435 HG23 ' O ' ' A' ' 74' ' ' THR . 4.5 t -43.0 128.19 4.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.128 179.96 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.489 ' CE2' ' CE2' ' A' ' 81' ' ' TYR . 52.3 m-85 -108.06 -179.93 4.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.941 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 2.8 tpp180 -112.65 132.15 55.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.829 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.997 HG21 ' HB2' ' A' ' 97' ' ' ALA . 11.7 p -54.18 -19.5 3.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.091 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -111.7 34.96 4.96 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.529 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -154.1 125.62 7.53 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.888 0.375 . . . . 0.0 111.022 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 58.8 p -78.5 168.24 20.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.04 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . 0.506 ' CZ ' ' CB ' ' A' ' 92' ' ' CYS . 22.3 p90 -166.38 167.47 15.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.859 -179.891 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.414 ' HB3' ' HA ' ' A' ' 91' ' ' ASP . 0.0 OUTLIER -138.99 132.45 30.25 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.849 179.89 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.423 ' HD2' ' OH ' ' A' ' 75' ' ' TYR . 3.3 mtp180 -136.2 140.91 34.26 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.023 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_endo -77.78 124.32 6.81 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.853 2.369 . . . . 0.0 112.327 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.535 ' O ' ' CB ' ' A' ' 86' ' ' ASP . 12.4 tppt? -129.27 108.37 10.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.879 179.845 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.535 ' CB ' ' O ' ' A' ' 85' ' ' LYS . 6.7 t0 87.86 -35.18 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.03 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . 0.5 ' CB ' ' O ' ' A' ' 86' ' ' ASP . 0.4 OUTLIER 159.02 -23.33 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.771 -179.999 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -98.32 154.84 17.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.875 -179.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 14.0 mt -106.05 135.0 46.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.072 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' TRP . . . . . 0.611 ' CD1' ' N ' ' A' ' 90' ' ' TRP . 0.1 OUTLIER -130.23 130.78 45.07 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.832 179.955 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.414 ' HA ' ' HB3' ' A' ' 82' ' ' GLU . 60.2 m-20 -72.58 62.41 0.55 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.942 -179.878 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . 0.506 ' CB ' ' CZ ' ' A' ' 81' ' ' TYR . 57.1 m -48.91 145.23 4.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.0 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.445 ' O ' ' N ' ' A' ' 95' ' ' ILE . 10.6 m -132.15 125.42 31.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.038 179.843 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 45.3 t -61.59 77.87 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.854 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.445 ' N ' ' O ' ' A' ' 93' ' ' THR . 1.5 mt -90.75 84.55 2.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.307 -179.84 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 157.1 -23.4 0.46 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.455 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.997 ' HB2' HG21 ' A' ' 77' ' ' VAL . . . 59.56 44.09 15.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.855 0.36 . . . . 0.0 111.042 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 159.63 -55.69 0.34 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.528 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 178.99 44.65 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.809 0.337 . . . . 0.0 110.973 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -74.61 -64.81 2.28 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.489 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.512 ' O ' ' N ' ' A' ' 103' ' ' SER . 1.5 ptt180 -177.7 62.79 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.725 0.298 . . . . 0.0 110.94 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.89 HD13 ' OD1' ' A' ' 68' ' ' ASP . 13.2 mt -36.15 91.94 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.135 -179.93 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.512 ' N ' ' O ' ' A' ' 101' ' ' ARG . 0.3 OUTLIER -74.23 145.98 43.67 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.815 179.986 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 29.7 m -146.27 137.78 24.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.828 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 3.4 t -143.1 127.19 17.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.15 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.572 HG13 ' CE3' ' A' ' 90' ' ' TRP . 3.0 mt -41.6 126.01 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.033 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -107.49 105.78 15.85 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.07 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . 0.503 ' O ' ' CB ' ' A' ' 109' ' ' ARG . 4.6 m-20 -69.02 82.1 0.31 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.904 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . 0.503 ' CB ' ' O ' ' A' ' 108' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.195 -0.907 . . . . 0.0 110.9 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo . . . . . 0 N--CA 1.462 -0.356 0 CA-C-O 120.787 0.245 . . . . 0.0 112.419 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . 0.454 ' HA2' HG13 ' A' ' 30' ' ' ILE . . . 126.86 -173.88 18.26 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.682 -0.771 . . . . 0.0 112.611 179.934 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 3.3 m -145.91 91.76 2.12 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.852 0.358 . . . . 0.0 110.779 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -57.3 129.59 42.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.003 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.455 ' OD2' ' CE2' ' A' ' 54' ' ' PHE . 0.4 OUTLIER -161.65 135.17 6.47 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.82 179.98 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.424 ' CG ' ' O ' ' A' ' 24' ' ' ASN . 36.3 t30 62.28 38.96 12.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.865 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 60.47 17.45 47.72 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.622 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.578 ' HB3' ' CE1' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -133.05 137.82 46.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.848 0.356 . . . . 0.0 110.949 -179.985 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 51.9 t-80 -105.38 96.87 6.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.834 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.578 ' CE1' ' HB3' ' A' ' 26' ' ' LYS . 10.4 m-30 -79.68 170.54 16.38 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.804 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.489 ' O ' ' HB2' ' A' ' 32' ' ' GLN . 4.8 tm0? -89.93 130.98 36.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.504 179.742 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.65 HD12 ' H ' ' A' ' 30' ' ' ILE . 4.3 mp -33.99 148.22 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.924 0.393 . . . . 0.0 111.383 -179.845 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.423 ' HB2' ' O ' ' A' ' 30' ' ' ILE . 34.1 m-20 76.47 4.53 3.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.847 -179.672 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.489 ' HB2' ' O ' ' A' ' 29' ' ' GLN . 7.2 tp60 -91.08 134.38 34.56 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.582 179.712 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.449 ' O ' ' NE2' ' A' ' 32' ' ' GLN . 20.9 mt-30 -103.17 148.31 25.93 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.034 -179.792 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . 0.551 ' CZ2' ' HB3' ' A' ' 45' ' ' CYS . 35.5 p90 -157.28 179.01 9.67 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.672 179.886 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.69 ' OE2' ' HB1' ' A' ' 42' ' ' ALA . 0.2 OUTLIER -118.54 122.16 42.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.904 0.383 . . . . 0.0 111.377 -179.551 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.9 ' O ' HD22 ' A' ' 43' ' ' LEU . 3.8 ttt85 -114.59 141.53 47.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.528 179.592 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.532 ' CG2' ' N ' ' A' ' 38' ' ' TYR . 1.4 m -102.03 162.35 12.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.037 -179.782 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.532 ' N ' ' CG2' ' A' ' 37' ' ' THR . 13.0 t80 177.02 115.26 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.754 179.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.513 ' O ' ' ND2' ' A' ' 41' ' ' ASN . 0.8 OUTLIER 74.66 34.43 0.74 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.831 -179.864 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 68.04 30.55 74.08 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.43 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.513 ' ND2' ' O ' ' A' ' 39' ' ' LEU . 22.6 m-80 -134.12 146.0 49.84 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 120.837 0.351 . . . . 0.0 110.962 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.892 ' C ' HD13 ' A' ' 43' ' ' LEU . . . -100.08 112.34 24.63 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.999 179.896 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.9 HD22 ' O ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -112.81 143.41 44.1 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.013 -179.989 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.497 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.7 t -93.7 126.9 46.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.348 179.261 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.57 ' SG ' ' CE1' ' A' ' 54' ' ' PHE . 6.2 m -105.64 166.94 10.1 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.698 -179.207 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.455 ' O ' ' HA ' ' A' ' 54' ' ' PHE . 26.0 m -150.49 124.47 9.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.679 179.642 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.485 ' SG ' ' HA ' ' A' ' 30' ' ' ILE . 15.1 t -79.79 130.39 35.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.032 -179.712 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -111.97 -25.59 9.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.93 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 94.58 -179.14 37.13 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.451 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 42.59 -129.69 5.0 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.59 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -89.33 -27.97 20.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.825 0.345 . . . . 0.0 110.979 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -49.69 -29.52 7.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.964 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 50.11 -125.37 19.95 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.629 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.57 ' CE1' ' SG ' ' A' ' 45' ' ' CYS . 1.1 p90 -132.85 160.2 37.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.829 0.347 . . . . 0.0 110.902 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -138.23 85.47 2.1 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.713 179.79 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.497 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.1 OUTLIER -63.3 158.9 19.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.045 -179.741 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -137.65 -70.13 0.44 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.844 179.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.484 ' HA ' ' HA ' ' A' ' 43' ' ' LEU . 85.0 p -172.59 176.86 3.12 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.822 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 46.3 tptt . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.78 180.0 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.422 ' O ' ' N ' ' A' ' 65' ' ' THR . 1.3 tt0 . . . . . 0 N--CA 1.456 -0.174 0 CA-C-O 120.897 0.38 . . . . 0.0 110.43 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 87.9 mt-10 -62.33 78.59 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.806 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.422 ' N ' ' O ' ' A' ' 63' ' ' GLU . 7.3 p -142.45 150.67 40.88 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.189 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.422 ' SG ' ' HB2' ' A' ' 75' ' ' TYR . 0.3 OUTLIER -152.02 178.73 9.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.613 179.924 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 12.0 t80 -168.73 100.94 0.4 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.966 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . 0.477 ' O ' ' O ' ' A' ' 69' ' ' LYS . 28.2 t0 -101.97 32.52 3.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.855 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.504 ' HD2' ' CE1' ' A' ' 70' ' ' TYR . 0.0 OUTLIER 39.07 -165.76 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.153 179.808 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . 0.504 ' CE1' ' HD2' ' A' ' 69' ' ' LYS . 12.4 m-85 74.56 -54.62 0.67 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.131 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -127.33 -4.25 6.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.295 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 51.69 26.13 16.22 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.361 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . 0.541 ' O ' ' CE1' ' A' ' 75' ' ' TYR . 35.7 t-20 -77.04 90.88 3.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.739 0.305 . . . . 0.0 110.965 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 56.2 m -49.52 119.41 3.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.036 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.541 ' CE1' ' O ' ' A' ' 73' ' ' ASN . 9.9 m-85 -102.95 172.8 6.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.818 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -111.92 133.55 54.04 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.781 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.447 ' HA ' ' HB3' ' A' ' 94' ' ' CYS . 53.1 t -49.4 -37.15 10.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.06 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -85.14 41.67 3.08 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.498 179.869 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -164.32 178.32 7.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.83 0.348 . . . . 0.0 110.993 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 1.052 HG22 HG23 ' A' ' 93' ' ' THR . 19.1 p -132.7 151.28 52.01 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.059 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 24.0 p90 -136.72 115.19 11.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.876 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -82.18 112.99 19.7 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.798 179.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.2 106.0 53.47 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.921 -179.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.466 ' HB3' HG12 ' A' ' 89' ' ' ILE . 71.5 Cg_endo -74.66 141.27 27.51 Favored 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.816 2.344 . . . . 0.0 112.303 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.462 ' O ' ' CB ' ' A' ' 86' ' ' ASP . 12.3 tptp -151.51 99.15 2.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.948 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.462 ' CB ' ' O ' ' A' ' 85' ' ' LYS . 0.3 OUTLIER 80.31 -167.54 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.907 -179.969 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.65 55.97 2.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.87 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 2.9 ptp -145.52 -60.97 0.34 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.881 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.466 HG12 ' HB3' ' A' ' 84' ' ' PRO . 60.9 mt 62.45 130.47 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.179 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' TRP . . . . . 0.614 ' CD1' ' N ' ' A' ' 90' ' ' TRP . 0.0 OUTLIER -137.65 172.76 12.48 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.884 179.971 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -110.24 82.68 1.63 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.902 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 23.2 m -68.77 135.05 50.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.981 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 1.052 HG23 HG22 ' A' ' 80' ' ' THR . 0.8 OUTLIER -115.91 174.76 5.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.924 179.782 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.633 ' H ' HG22 ' A' ' 93' ' ' THR . 36.7 t -108.99 40.27 1.85 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.87 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 2.0 mt -56.76 110.68 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.38 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 140.74 135.86 3.25 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.497 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -60.97 -14.77 24.98 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.838 0.352 . . . . 0.0 111.113 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . 0.42 ' O ' ' HB3' ' A' ' 99' ' ' ARG . . . -144.08 24.98 2.07 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.535 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.624 ' HG2' HD11 ' A' ' 102' ' ' ILE . 4.5 tmm_? 64.8 132.22 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.843 0.354 . . . . 0.0 110.928 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 165.76 -36.04 0.26 Allowed Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.42 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 3.1 mtm-85 -102.52 43.12 1.09 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.832 0.348 . . . . 0.0 110.846 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.673 ' H ' HD12 ' A' ' 102' ' ' ILE . 5.2 mp -54.41 95.47 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.142 -179.821 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.72 124.66 28.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.649 179.774 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.523 ' SG ' HG22 ' A' ' 102' ' ' ILE . 4.1 m -129.04 121.96 28.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.994 -179.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 1.1 t -135.83 139.88 43.79 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.985 179.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.541 ' O ' ' HB2' ' A' ' 107' ' ' ALA . 2.6 mt -61.1 143.05 15.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.101 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.541 ' HB2' ' O ' ' A' ' 106' ' ' ILE . . . 171.6 117.79 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.116 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -163.68 116.47 1.47 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.85 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 18.3 ttp180 . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.267 -0.873 . . . . 0.0 110.9 179.912 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo . . . . . 0 C--O 1.231 0.147 0 CA-C-O 120.845 0.269 . . . . 0.0 112.265 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 114.43 167.6 15.89 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.648 -0.786 . . . . 0.0 112.536 179.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 8.9 p -152.59 123.34 7.38 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.793 0.33 . . . . 0.0 110.847 -180.0 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 7.0 t80 -92.08 95.4 9.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.924 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.446 ' OD2' ' CE1' ' A' ' 54' ' ' PHE . 1.2 m-20 -117.0 139.61 50.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.821 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.464 ' OD1' ' O ' ' A' ' 24' ' ' ASN . 27.5 t-20 50.09 45.59 25.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.709 -179.959 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.12 16.86 28.09 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.363 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.95 152.56 47.74 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.818 0.342 . . . . 0.0 110.936 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 20.9 t-80 -116.85 97.97 6.25 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.136 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 15.6 m-85 -79.87 -178.72 6.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.854 179.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.495 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 2.1 tt0 -93.64 120.65 34.18 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.588 179.709 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.705 HD12 ' H ' ' A' ' 30' ' ' ILE . 4.4 mp -33.86 138.91 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.353 -179.825 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.488 ' N ' ' O ' ' A' ' 47' ' ' CYS . 34.3 m-20 76.97 5.35 3.31 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.762 -179.686 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.495 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 11.8 tt0 -86.61 154.19 21.22 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.774 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.965 ' CG ' HG23 ' A' ' 46' ' ' THR . 36.5 mt-30 -122.64 124.84 44.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.15 -179.683 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . 0.548 ' CZ3' ' HB2' ' A' ' 47' ' ' CYS . 22.9 p90 -131.0 175.63 8.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.791 179.742 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 33.6 tp10 -100.18 126.64 46.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.863 0.363 . . . . 0.0 111.313 -179.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.451 ' O ' ' O ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -138.25 -161.93 1.24 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.468 179.643 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.471 ' HG1' ' C ' ' A' ' 41' ' ' ASN . 2.2 t -143.83 141.46 30.37 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.952 0.406 . . . . 0.0 111.452 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.769 ' HB2' HD22 ' A' ' 43' ' ' LEU . 9.8 t80 -131.17 132.73 44.94 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.461 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.4 mp 63.44 16.96 9.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.947 0.404 . . . . 0.0 110.319 -179.53 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 83.41 37.07 12.74 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.938 -0.649 . . . . 0.0 112.563 -179.871 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.471 ' C ' ' HG1' ' A' ' 37' ' ' THR . 64.1 m-80 -146.55 139.7 25.58 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 120.77 0.319 . . . . 0.0 111.075 -179.9 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -48.04 134.19 14.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.835 179.739 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.845 HD12 ' O ' ' A' ' 57' ' ' GLU . 0.0 OUTLIER -165.36 147.44 7.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.02 0.438 . . . . 0.0 110.954 -179.752 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.465 ' O ' ' HB3' ' A' ' 56' ' ' CYS . 5.1 t -90.11 134.46 29.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.809 179.822 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.488 ' HA ' ' HA ' ' A' ' 56' ' ' CYS . 5.4 m -119.65 123.4 43.77 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.107 -179.706 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.965 HG23 ' CG ' ' A' ' 33' ' ' GLN . 0.2 OUTLIER -94.77 -174.04 3.17 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.003 179.868 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.659 ' H ' HG22 ' A' ' 46' ' ' THR . 27.8 t -138.69 119.8 14.55 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.85 0.357 . . . . 0.0 110.88 -179.843 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 9.9 m-30 -90.91 -46.32 8.25 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.261 -179.871 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 103.14 166.33 25.81 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.45 -179.737 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 65.31 -116.83 9.23 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.612 179.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 4.9 p -125.11 -6.85 7.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.731 0.301 . . . . 0.0 111.187 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 4.0 mtm180 -56.91 -29.28 62.91 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.897 0.379 . . . . 0.0 110.876 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 64.33 137.2 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.729 179.828 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.528 ' CB ' ' O ' ' A' ' 46' ' ' THR . 38.5 p90 -59.28 -167.8 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.574 0.226 . . . . 0.0 110.671 179.737 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.524 ' O ' ' CB ' ' A' ' 56' ' ' CYS . 2.3 t30 -147.16 -49.95 0.19 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.821 0.343 . . . . 0.0 111.601 -179.739 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.524 ' CB ' ' O ' ' A' ' 55' ' ' ASN . 5.2 m 85.62 -172.64 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.424 -179.611 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.845 ' O ' HD12 ' A' ' 43' ' ' LEU . 3.9 tt0 -156.78 -89.23 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.858 0.361 . . . . 0.0 111.359 -179.837 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.468 ' HA ' ' HA ' ' A' ' 43' ' ' LEU . 0.3 OUTLIER 170.97 146.44 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.835 -179.701 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.813 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.407 ' HG3' HG11 ' A' ' 77' ' ' VAL . 0.1 OUTLIER . . . . . 0 N--CA 1.456 -0.144 0 CA-C-O 120.841 0.353 . . . . 0.0 110.55 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -163.86 139.4 6.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.84 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.503 ' OG1' ' CG2' ' A' ' 74' ' ' THR . 12.6 p -57.95 -176.63 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.273 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 60.1 m -114.46 156.43 24.56 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.944 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 89.8 t80 -112.35 87.6 2.61 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.972 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.95 85.96 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.937 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 4.2 ptmt -41.08 -28.2 0.08 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.869 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 14.6 m-30 -40.02 -72.74 0.06 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.924 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.516 HG22 ' O ' ' A' ' 71' ' ' THR . 6.3 m -117.78 20.79 13.25 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.099 179.817 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 55.95 54.23 36.74 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.46 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . 0.434 ' OD1' ' HB ' ' A' ' 71' ' ' THR . 0.4 OUTLIER -108.41 -162.9 0.84 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.763 0.316 . . . . 0.0 110.846 179.949 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.503 ' CG2' ' OG1' ' A' ' 65' ' ' THR . 1.1 m -146.01 133.05 20.3 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.065 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.443 ' O ' ' HB ' ' A' ' 65' ' ' THR . 2.7 m-85 -123.22 128.64 50.29 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.859 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 2.7 mmt180 -45.55 137.5 5.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.849 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.42 ' HA ' ' SG ' ' A' ' 94' ' ' CYS . 12.2 p -82.09 -17.03 11.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.194 -179.912 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -102.04 9.38 56.45 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.446 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -138.52 159.26 42.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.828 0.347 . . . . 0.0 110.896 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.497 ' OG1' ' N ' ' A' ' 81' ' ' TYR . 0.1 OUTLIER -106.59 -173.4 2.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.989 179.943 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . 0.532 ' CZ ' ' HB3' ' A' ' 92' ' ' CYS . 15.2 p90 -164.74 -177.81 4.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.868 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -135.2 110.54 9.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.82 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.61 96.05 9.7 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.904 -179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -69.78 84.37 0.66 Allowed 'Trans proline' 0 C--O 1.231 0.145 0 C-N-CA 122.78 2.32 . . . . 0.0 112.227 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.87 139.37 32.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.91 179.887 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 46.32 -157.89 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.935 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . 0.432 ' O ' ' HB2' ' A' ' 88' ' ' MET . 0.4 OUTLIER -84.03 62.8 7.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.931 -179.986 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . 0.432 ' HB2' ' O ' ' A' ' 87' ' ' SER . 1.3 ttt 174.44 149.6 0.08 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.926 -179.944 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.534 ' C ' ' CD1' ' A' ' 90' ' ' TRP . 17.1 mt -110.37 157.79 10.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.124 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' TRP . . . . . 0.778 ' CZ3' HD11 ' A' ' 106' ' ' ILE . 0.1 OUTLIER -146.0 134.08 21.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.948 179.989 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 29.2 t0 -72.41 62.8 0.53 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.774 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . 0.532 ' HB3' ' CZ ' ' A' ' 81' ' ' TYR . 67.9 m -55.49 146.04 21.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.052 -179.87 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.477 ' O ' ' N ' ' A' ' 95' ' ' ILE . 21.2 m -144.03 141.31 30.04 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.96 179.806 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.42 ' SG ' ' HA ' ' A' ' 77' ' ' VAL . 50.3 t -66.29 60.21 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.975 -179.759 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.603 HD12 ' CB ' ' A' ' 103' ' ' SER . 2.6 mt -68.77 80.17 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.001 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -114.34 -107.15 2.71 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.462 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . 55.09 79.79 0.14 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.748 0.309 . . . . 0.0 111.085 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 82.65 -55.28 4.99 Favored Glycine 0 N--CA 1.453 -0.207 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.448 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 6.8 mtt180 -179.12 63.23 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.889 0.376 . . . . 0.0 110.965 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 0.459 ' O ' ' HB3' ' A' ' 101' ' ' ARG . . . -89.28 -28.21 20.73 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.528 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.517 ' N ' ' O ' ' A' ' 95' ' ' ILE . 0.0 OUTLIER 66.8 104.24 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.81 0.338 . . . . 0.0 110.9 179.952 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.476 HG21 ' OH ' ' A' ' 81' ' ' TYR . 2.5 mp -36.32 128.36 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.126 179.81 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.603 ' CB ' HD12 ' A' ' 95' ' ' ILE . 29.2 t -110.21 163.08 13.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.077 -179.911 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 82.3 m -154.49 119.9 5.09 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.935 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 22.1 m -133.45 124.7 27.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.167 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.778 HD11 ' CZ3' ' A' ' 90' ' ' TRP . 2.4 mp -58.79 87.67 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.116 179.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -108.28 141.95 39.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.197 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -79.74 134.15 36.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.935 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.814 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.466 ' C ' HD11 ' A' ' 30' ' ' ILE . 94.7 Cg_endo . . . . . 0 N--CA 1.463 -0.297 0 CA-C-O 120.733 0.222 . . . . 0.0 112.386 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 176.81 -161.66 29.63 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.515 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.576 ' O ' ' CD2' ' A' ' 27' ' ' HIS . 0.1 OUTLIER -159.15 178.38 10.08 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.779 0.323 . . . . 0.0 110.878 -179.946 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 48.2 t80 -161.89 126.67 3.38 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.945 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -163.83 159.21 20.9 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.931 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 46.19 31.96 1.34 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.914 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 65.83 21.31 69.27 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.56 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.26 152.32 44.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.831 0.348 . . . . 0.0 110.91 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . 0.576 ' CD2' ' O ' ' A' ' 21' ' ' CYS . 6.0 t-160 -117.29 96.47 5.44 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.136 -179.689 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -88.53 -162.45 0.85 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.9 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.524 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 0.5 OUTLIER -124.83 156.7 37.4 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.756 179.868 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.679 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.5 mp -51.99 150.46 1.04 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.37 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.125 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 17.5 m-20 64.87 13.93 8.88 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.776 -179.871 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.524 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 12.9 tt0 -98.54 145.53 26.71 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.792 -179.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.727 ' HG2' HG23 ' A' ' 46' ' ' THR . 14.1 mt-30 -118.01 143.69 46.19 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.848 -179.78 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . 0.598 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 35.9 p90 -144.13 -172.07 3.69 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.829 179.83 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -116.08 133.14 56.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.928 0.394 . . . . 0.0 111.239 -179.814 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.4 171.24 14.77 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.502 179.72 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -134.69 142.8 46.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.937 0.398 . . . . 0.0 110.787 -179.841 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.502 ' CB ' HD22 ' A' ' 43' ' ' LEU . 0.7 OUTLIER -155.21 120.46 4.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.686 179.671 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.517 HD12 ' HA ' ' A' ' 39' ' ' LEU . 1.6 tp 80.91 22.62 0.36 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.58 -179.732 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 68.19 37.71 87.11 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.918 -0.658 . . . . 0.0 112.438 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.434 ' O ' ' C ' ' A' ' 42' ' ' ALA . 51.1 m-80 -148.35 133.37 18.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.667 0.27 . . . . 0.0 110.945 179.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.434 ' C ' ' O ' ' A' ' 41' ' ' ASN . . . -35.69 153.92 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.801 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.502 HD22 ' CB ' ' A' ' 38' ' ' TYR . 3.1 tp -161.52 146.05 13.2 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.144 -179.543 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.493 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 3.9 t -121.61 136.85 57.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.417 179.547 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.598 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 0.7 OUTLIER -116.41 161.39 19.14 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.322 -179.509 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.727 HG23 ' HG2' ' A' ' 33' ' ' GLN . 1.4 m -144.29 127.73 16.93 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.936 179.818 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.525 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 19.4 t -87.28 138.61 31.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.057 -179.868 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.554 ' C ' HG23 ' A' ' 30' ' ' ILE . 11.6 m-85 -122.4 -33.13 3.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.928 179.953 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.42 ' O ' ' HB2' ' A' ' 52' ' ' ARG . . . 64.75 -165.7 32.82 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.498 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . 0.501 ' O ' ' CB ' ' A' ' 51' ' ' SER . . . 56.65 31.13 60.19 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.523 -179.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . 0.501 ' CB ' ' O ' ' A' ' 50' ' ' GLY . 0.8 OUTLIER 83.88 -10.01 0.95 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.706 0.289 . . . . 0.0 110.995 -179.978 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.42 ' HB2' ' O ' ' A' ' 49' ' ' GLY . 34.1 mtt85 -67.85 -46.78 70.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.021 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 92.47 -141.33 15.53 Favored Glycine 0 N--CA 1.446 -0.638 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.608 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.568 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 5.8 p90 -143.27 157.0 44.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.844 0.354 . . . . 0.0 110.92 -179.947 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 -131.57 124.89 30.97 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.809 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.493 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.5 OUTLIER -100.5 163.15 12.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.021 -179.963 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.466 ' O ' ' HA ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -175.02 -177.62 1.1 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.937 179.898 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -65.95 178.58 1.07 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.932 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.891 179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.406 ' O ' ' HB1' ' A' ' 97' ' ' ALA . 2.7 tt0 . . . . . 0 N--CA 1.446 -0.632 0 CA-C-O 120.811 0.338 . . . . 0.0 111.165 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.704 ' O ' HG23 ' A' ' 65' ' ' THR . 3.1 mt-10 -64.2 120.85 12.9 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.91 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.704 HG23 ' O ' ' A' ' 64' ' ' GLU . 0.2 OUTLIER 175.59 -171.82 0.07 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.116 179.952 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.834 ' O ' HG23 ' A' ' 74' ' ' THR . 4.1 t -178.27 169.17 1.87 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.923 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.413 ' O ' ' HB3' ' A' ' 68' ' ' ASP . 49.2 t80 -119.59 -52.95 2.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.959 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . 0.414 ' HB3' ' O ' ' A' ' 73' ' ' ASN . 17.6 t70 71.8 84.04 0.13 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.876 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.495 ' O ' ' CB ' ' A' ' 70' ' ' TYR . 0.0 OUTLIER -57.53 -170.61 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.903 179.914 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . 0.709 ' C ' HG22 ' A' ' 71' ' ' THR . 7.3 m-85 84.4 -4.2 1.03 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.05 -179.882 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.709 HG22 ' C ' ' A' ' 70' ' ' TYR . 0.0 OUTLIER 165.26 -26.22 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.2 -179.95 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 97.64 76.18 1.27 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.478 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . 0.414 ' O ' ' HB3' ' A' ' 68' ' ' ASP . 2.6 m-20 -122.09 80.16 1.67 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.749 0.309 . . . . 0.0 110.96 179.954 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.834 HG23 ' O ' ' A' ' 66' ' ' CYS . 94.4 m -50.58 110.35 0.4 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.977 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.459 ' HB2' ' SG ' ' A' ' 94' ' ' CYS . 18.1 m-85 -108.68 164.08 12.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.646 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 4.2 mtt180 -78.83 117.37 19.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.952 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.46 ' HA ' ' O ' ' A' ' 94' ' ' CYS . 7.6 p -47.83 -22.69 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.191 -179.922 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -95.06 11.54 69.29 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.517 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -144.79 151.12 38.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.814 0.34 . . . . 0.0 110.962 179.961 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.982 HG22 HG23 ' A' ' 93' ' ' THR . 0.6 OUTLIER -96.72 -155.41 0.48 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.14 -179.921 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . 0.532 ' O ' ' CB ' ' A' ' 82' ' ' GLU . 9.6 p90 -172.02 -35.13 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.069 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.532 ' CB ' ' O ' ' A' ' 81' ' ' TYR . 0.7 OUTLIER 87.29 157.6 0.07 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.897 179.9 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 2.7 mtt-85 178.44 119.01 0.19 Allowed Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.849 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.73 167.62 25.17 Favored 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.748 2.299 . . . . 0.0 112.477 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.436 ' O ' ' N ' ' A' ' 87' ' ' SER . 0.0 OUTLIER -171.8 150.46 2.65 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.649 179.976 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 56.8 -85.04 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.886 -179.857 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . 0.436 ' N ' ' O ' ' A' ' 85' ' ' LYS . 0.4 OUTLIER -159.71 23.18 0.18 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.952 179.848 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . 0.409 ' O ' ' CD1' ' A' ' 90' ' ' TRP . 0.0 OUTLIER -148.85 146.1 27.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.971 -179.854 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 10.4 mt -90.83 134.44 29.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.986 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' TRP . . . . . 0.559 ' CH2' HD11 ' A' ' 106' ' ' ILE . 1.0 OUTLIER -125.44 144.55 50.47 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.038 -179.901 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 57.9 m-20 -80.04 67.68 5.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.658 179.748 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 23.1 m -55.09 124.62 17.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.035 -179.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.982 HG23 HG22 ' A' ' 80' ' ' THR . 2.0 m -117.87 113.96 22.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.977 179.819 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.555 ' HA ' HD12 ' A' ' 102' ' ' ILE . 0.0 OUTLIER -54.41 87.62 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.878 -179.81 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.467 HG13 ' O ' ' A' ' 93' ' ' THR . 2.3 mt -117.2 95.52 3.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.196 -179.925 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.414 ' HA3' ' HA2' ' A' ' 100' ' ' GLY . . . -145.98 -94.39 0.16 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.616 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.406 ' HB1' ' O ' ' A' ' 63' ' ' GLU . . . 62.68 41.18 9.47 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.846 0.355 . . . . 0.0 111.06 -179.867 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 139.21 -27.32 2.65 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.554 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.61 -31.71 3.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.841 0.353 . . . . 0.0 110.912 -179.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 0.414 ' HA2' ' HA3' ' A' ' 96' ' ' GLY . . . 60.36 50.71 64.65 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.548 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 6.0 ptp180 -99.18 54.83 0.98 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.787 0.327 . . . . 0.0 110.928 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.555 HD12 ' HA ' ' A' ' 94' ' ' CYS . 5.4 mm -37.3 126.71 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.244 -179.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 5.9 t -99.14 131.06 45.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.888 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 24.3 m -135.4 117.45 15.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.031 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 7.3 t -130.86 161.25 32.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.123 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.559 HD11 ' CH2' ' A' ' 90' ' ' TRP . 3.2 mp -82.89 121.21 35.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.091 179.911 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -49.68 140.73 10.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.149 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 65.0 t-20 -88.76 -34.85 16.97 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.869 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . 0.446 ' OXT' ' HG3' ' A' ' 109' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.947 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_exo . . . . . 0 C--O 1.232 0.2 0 CA-C-O 120.862 0.276 . . . . 0.0 112.3 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 96.66 -156.51 21.08 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.588 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 59.7 m -147.99 97.39 2.79 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.857 0.361 . . . . 0.0 110.847 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -64.97 150.03 48.72 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.826 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.466 ' OD1' ' O ' ' A' ' 26' ' ' LYS . 4.7 p-10 -133.86 -159.99 1.01 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.14 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.421 ' C ' ' O ' ' A' ' 23' ' ' ASP . 1.5 m-20 -34.45 -42.99 0.15 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.171 -179.816 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -173.15 32.11 0.11 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.598 -0.81 . . . . 0.0 112.611 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.592 ' HB3' ' CZ ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -139.93 134.92 32.26 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.815 0.34 . . . . 0.0 110.843 179.964 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 5.8 t-160 -114.21 86.77 2.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.892 -179.67 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.592 ' CZ ' ' HB3' ' A' ' 26' ' ' LYS . 1.6 m-85 -79.62 -168.96 1.74 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.0 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -105.92 165.53 11.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.792 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.702 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.1 mp -58.68 150.35 5.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.473 -179.772 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 67.5 m-80 61.04 13.34 4.56 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.118 179.785 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.405 ' O ' ' CZ3' ' A' ' 34' ' ' TRP . 12.4 tt0 -91.3 150.0 21.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.679 179.813 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.454 ' HG2' HG23 ' A' ' 46' ' ' THR . 11.8 mt-30 -114.41 145.02 42.37 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.137 -179.73 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . 0.585 ' CZ2' ' HB3' ' A' ' 45' ' ' CYS . 44.1 p90 -151.59 175.71 12.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.677 179.656 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -111.24 119.8 40.12 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.957 0.408 . . . . 0.0 111.455 -179.563 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.474 ' N ' ' O ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -110.7 -179.84 3.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.369 179.466 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.459 ' CG2' ' N ' ' A' ' 38' ' ' TYR . 1.0 OUTLIER -135.73 159.78 40.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.992 0.425 . . . . 0.0 110.975 -179.669 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.526 ' HB2' HD22 ' A' ' 43' ' ' LEU . 2.3 t80 -178.42 137.06 0.16 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.54 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.48 ' HA ' HD12 ' A' ' 39' ' ' LEU . 0.4 OUTLIER 59.04 27.55 16.52 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.613 -179.746 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 67.37 49.82 48.88 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.889 -0.672 . . . . 0.0 112.666 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 68.1 m-80 -152.52 167.14 29.79 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.818 0.342 . . . . 0.0 111.016 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.735 ' O ' HD12 ' A' ' 43' ' ' LEU . . . -86.54 131.46 34.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.75 179.693 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.735 HD12 ' O ' ' A' ' 42' ' ' ALA . 8.5 mp -127.85 155.45 44.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.319 -179.658 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.484 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 1.9 t -120.58 121.64 65.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.426 179.466 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.585 ' HB3' ' CZ2' ' A' ' 34' ' ' TRP . 1.3 m -106.99 163.29 13.1 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.281 -179.516 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.454 HG23 ' HG2' ' A' ' 33' ' ' GLN . 2.9 m -149.25 117.52 6.44 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.832 179.782 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.468 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 21.1 t -73.97 134.49 43.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.072 -179.811 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.542 ' CB ' ' HB3' ' A' ' 52' ' ' ARG . 6.8 m-85 -107.24 -29.7 9.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.863 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 100.27 168.0 29.07 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.451 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 48.99 -123.27 10.6 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.38 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -105.15 -4.53 21.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.764 0.316 . . . . 0.0 110.998 179.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.542 ' HB3' ' CB ' ' A' ' 48' ' ' TYR . 2.2 mtt85 -47.9 -28.16 2.51 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.905 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 60.13 146.7 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.592 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.564 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 22.9 p90 -74.96 177.7 6.13 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.732 0.301 . . . . 0.0 110.941 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -154.85 118.67 4.6 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.958 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.484 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.8 OUTLIER -103.08 150.74 23.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.874 179.942 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.445 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 0.3 OUTLIER -136.01 -86.08 0.35 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.906 -179.958 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.431 ' HA ' ' HA ' ' A' ' 43' ' ' LEU . 5.2 p -170.01 -166.05 0.53 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.96 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.437 ' HD2' ' C ' ' A' ' 59' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.878 -179.943 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.567 ' O ' HG22 ' A' ' 65' ' ' THR . 1.8 tt0 . . . . . 0 N--CA 1.455 -0.176 0 CA-C-O 120.794 0.331 . . . . 0.0 110.505 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.439 ' C ' HG22 ' A' ' 65' ' ' THR . 5.4 tt0 54.07 58.36 5.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.829 -180.0 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.567 HG22 ' O ' ' A' ' 63' ' ' GLU . 0.2 OUTLIER -160.81 -176.44 5.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.007 -179.998 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.495 ' N ' ' OG1' ' A' ' 65' ' ' THR . 0.6 OUTLIER -171.72 175.8 3.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.924 179.913 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.467 ' CE1' ' HA ' ' A' ' 69' ' ' LYS . 20.0 t80 -165.21 110.13 0.9 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.833 -179.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . 0.559 ' O ' ' CD2' ' A' ' 70' ' ' TYR . 44.4 t0 -108.45 38.5 2.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.883 -179.947 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.584 ' HG3' ' CD1' ' A' ' 70' ' ' TYR . 4.3 ptmt 34.22 -154.13 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.078 179.988 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . 0.584 ' CD1' ' HG3' ' A' ' 69' ' ' LYS . 15.5 m-85 75.29 -54.22 0.65 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.949 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -138.47 -62.43 0.57 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.244 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 132.53 44.9 0.14 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.572 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -88.95 74.06 8.24 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.795 0.331 . . . . 0.0 111.011 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 33.7 m -45.87 107.88 0.11 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.927 0.394 . . . . 0.0 111.029 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 -85.47 -157.98 0.35 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.884 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . 0.433 ' HB2' ' HB2' ' A' ' 79' ' ' ASP . 16.2 mtm180 -143.53 135.62 26.77 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.779 179.857 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 52.9 t -43.9 -28.06 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.055 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -109.53 31.03 7.91 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.424 179.813 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . 0.433 ' HB2' ' HB2' ' A' ' 76' ' ' ARG . 0.6 OUTLIER -128.47 106.21 8.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.845 0.355 . . . . 0.0 110.829 179.998 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.618 HG23 HG23 ' A' ' 93' ' ' THR . 0.0 OUTLIER -85.94 118.96 25.74 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.144 -179.974 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . 0.489 ' CZ ' ' HB3' ' A' ' 92' ' ' CYS . 30.1 p90 -120.06 173.87 6.83 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.753 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.446 ' HA ' ' O ' ' A' ' 90' ' ' TRP . 19.4 pt-20 -140.13 155.92 46.77 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.754 179.912 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.441 ' CZ ' ' HE2' ' A' ' 85' ' ' LYS . 0.0 OUTLIER -136.42 119.11 11.93 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.86 -179.929 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.66 95.09 0.62 Allowed 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.622 2.214 . . . . 0.0 112.242 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.441 ' HE2' ' CZ ' ' A' ' 83' ' ' ARG . 0.4 OUTLIER -146.81 163.76 34.99 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.905 -179.952 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 7.4 t0 56.21 49.51 15.23 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.832 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 9.3 m 43.54 31.17 0.4 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.923 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -159.18 175.56 13.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.892 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.458 ' O ' ' HA ' ' A' ' 106' ' ' ILE . 1.6 mp -126.27 134.17 67.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.158 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' TRP . . . . . 0.618 ' CD1' ' N ' ' A' ' 90' ' ' TRP . 0.0 OUTLIER -130.08 124.93 33.96 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.837 179.956 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.408 ' C ' ' O ' ' A' ' 81' ' ' TYR . 0.3 OUTLIER -78.93 71.14 5.37 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.993 -179.89 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . 0.489 ' HB3' ' CZ ' ' A' ' 81' ' ' TYR . 0.5 OUTLIER -45.97 136.42 6.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.895 179.808 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.618 HG23 HG23 ' A' ' 80' ' ' THR . 7.2 m -115.34 122.21 45.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.164 -179.906 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.452 ' SG ' ' O ' ' A' ' 96' ' ' GLY . 28.5 t -67.62 69.84 0.11 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.718 179.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -70.3 -7.88 9.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.408 -179.753 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.477 ' HA3' ' HA3' ' A' ' 100' ' ' GLY . . . -132.15 -165.6 11.35 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.55 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.419 ' HA ' ' O ' ' A' ' 65' ' ' THR . . . -140.3 -41.29 0.42 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.919 0.39 . . . . 0.0 110.927 179.912 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -152.88 17.42 0.73 Allowed Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.322 179.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 170.8 36.97 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.784 0.325 . . . . 0.0 110.957 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 0.477 ' HA3' ' HA3' ' A' ' 96' ' ' GLY . . . -97.8 -97.18 1.98 Allowed Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.563 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.496 ' O ' ' CG ' ' A' ' 101' ' ' ARG . 0.0 OUTLIER 170.55 75.17 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.792 0.33 . . . . 0.0 110.921 179.924 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 18.8 mt -58.14 79.55 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.085 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.481 ' N ' ' O ' ' A' ' 101' ' ' ARG . 9.6 t -58.65 167.82 1.38 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.033 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.415 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 0.0 OUTLIER -146.8 104.95 3.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.774 179.937 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 2.8 t -118.55 135.31 54.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.117 -179.896 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.48 ' HA ' ' HA ' ' A' ' 90' ' ' TRP . 2.4 mp -60.2 142.3 15.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.914 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -132.95 107.31 8.21 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.052 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . 0.417 ' O ' ' C ' ' A' ' 109' ' ' ARG . 32.0 t-20 -112.13 129.81 56.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.998 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . 0.417 ' C ' ' O ' ' A' ' 108' ' ' ASN . 1.0 OUTLIER . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.155 -0.926 . . . . 0.0 110.852 179.959 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo . . . . . 0 N--CA 1.464 -0.253 0 CA-C-O 120.841 0.267 . . . . 0.0 112.418 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 126.89 171.88 13.17 Favored Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.762 -0.733 . . . . 0.0 112.512 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 50.6 m -112.19 85.66 2.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.781 0.325 . . . . 0.0 110.793 -179.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -74.78 124.05 26.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.0 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.425 ' O ' ' CG ' ' A' ' 24' ' ' ASN . 0.3 OUTLIER -167.91 147.6 4.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.889 179.897 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.429 ' ND2' ' HB2' ' A' ' 26' ' ' LYS . 8.0 p-10 46.02 53.41 9.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.934 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 53.92 20.27 13.22 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.541 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.589 ' HB3' ' CZ ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -125.83 133.74 51.88 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.807 0.337 . . . . 0.0 111.004 -179.996 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 4.0 t-160 -117.97 84.18 2.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.956 -179.915 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.589 ' CZ ' ' HB3' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -79.91 167.88 19.95 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.79 179.906 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.483 ' O ' ' HB2' ' A' ' 32' ' ' GLN . 8.5 mt-30 -93.12 170.7 9.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.786 179.808 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.719 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.0 mp -65.49 153.74 8.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.338 -179.909 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 84.6 m-20 55.01 17.69 1.97 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.089 179.8 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.483 ' HB2' ' O ' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -97.1 139.26 33.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.816 179.809 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 11.7 mt-30 -107.01 148.66 28.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.872 -179.801 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . 0.534 ' CE2' ' CE1' ' A' ' 28' ' ' TYR . 38.8 p90 -165.75 -167.41 1.1 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.902 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.404 ' OE2' ' HE2' ' A' ' 59' ' ' LYS . 8.5 mt-10 -119.18 125.25 48.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.067 -179.786 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.481 ' O ' HD22 ' A' ' 43' ' ' LEU . 0.4 OUTLIER -121.6 123.39 41.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.55 179.714 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.483 ' HA ' ' O ' ' A' ' 41' ' ' ASN . 1.3 m -99.89 136.27 40.05 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.828 -179.565 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.812 ' CE1' HD13 ' A' ' 39' ' ' LEU . 5.8 t80 -152.04 142.76 22.86 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.707 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.812 HD13 ' CE1' ' A' ' 38' ' ' TYR . 0.0 OUTLIER 53.37 41.4 32.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.674 -179.761 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 60.3 50.56 66.3 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.521 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.483 ' O ' ' HA ' ' A' ' 37' ' ' THR . 60.0 m-80 -154.37 154.11 32.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.706 0.288 . . . . 0.0 111.024 179.993 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 1.019 ' C ' HD13 ' A' ' 43' ' ' LEU . . . -100.46 111.12 23.34 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.91 179.882 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 1.019 HD13 ' C ' ' A' ' 42' ' ' ALA . 0.0 OUTLIER -119.94 131.4 55.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.385 -179.631 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.505 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.4 t -77.83 128.61 38.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 178.762 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.561 ' SG ' ' CE1' ' A' ' 54' ' ' PHE . 1.5 m -110.1 144.19 39.07 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.014 0.435 . . . . 0.0 111.592 -179.151 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.449 ' O ' ' CD1' ' A' ' 48' ' ' TYR . 29.3 m -134.53 110.42 9.34 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.764 179.442 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.44 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 15.2 t -67.54 138.31 56.4 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.954 -179.691 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.526 ' O ' ' CG2' ' A' ' 30' ' ' ILE . 2.0 m-85 -105.38 -51.85 2.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.958 179.984 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 128.27 -179.69 16.4 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.427 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 41.15 -121.45 2.09 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.452 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -108.29 2.48 22.67 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.667 0.27 . . . . 0.0 111.093 -179.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.425 ' O ' ' O ' ' A' ' 53' ' ' GLY . 61.5 mtt180 -59.24 -42.09 90.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.944 179.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . 0.425 ' O ' ' O ' ' A' ' 52' ' ' ARG . . . 59.04 143.71 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.431 -179.921 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.561 ' CE1' ' SG ' ' A' ' 45' ' ' CYS . 1.3 p90 -58.03 150.28 21.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.943 0.401 . . . . 0.0 110.947 -179.926 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -104.46 -33.96 8.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.652 179.869 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.505 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.1 OUTLIER 59.27 148.29 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.051 179.864 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -130.08 -88.9 0.49 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.963 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.475 ' HA ' ' HA ' ' A' ' 43' ' ' LEU . 0.4 OUTLIER -158.0 -162.96 1.22 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.874 -179.967 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.404 ' HE2' ' OE2' ' A' ' 35' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--N 1.331 -0.217 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.974 -179.918 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.441 ' CD ' ' CG2' ' A' ' 65' ' ' THR . 0.2 OUTLIER . . . . . 0 N--CA 1.447 -0.602 0 CA-C-O 120.81 0.338 . . . . 0.0 111.134 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 46.83 62.35 2.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.904 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.441 ' CG2' ' CD ' ' A' ' 63' ' ' GLU . 7.3 t -178.31 -160.11 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.189 -179.931 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.617 ' O ' HG23 ' A' ' 74' ' ' THR . 2.0 p -175.63 -178.0 1.04 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.869 -179.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -136.94 107.1 6.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.976 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . 0.498 ' O ' ' N ' ' A' ' 72' ' ' GLY . 12.2 t70 -78.29 67.02 4.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.745 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.402 ' HG3' ' CD1' ' A' ' 70' ' ' TYR . 10.9 ptmt -41.27 -32.16 0.27 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.026 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . 0.458 ' CD1' ' N ' ' A' ' 70' ' ' TYR . 1.7 m-30 -57.17 -33.13 67.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.858 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 3.9 m -126.46 -43.24 1.76 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.175 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . 0.498 ' N ' ' O ' ' A' ' 68' ' ' ASP . . . 111.37 1.61 27.89 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.476 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -89.22 111.69 22.55 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.731 0.3 . . . . 0.0 110.892 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.617 HG23 ' O ' ' A' ' 66' ' ' CYS . 55.5 m -64.81 128.67 36.73 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.018 179.878 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.448 ' CE2' ' HB2' ' A' ' 68' ' ' ASP . 27.7 m-85 -116.19 -171.65 2.03 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.769 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 5.7 ttt180 -103.24 129.97 50.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.808 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.441 ' HA ' ' O ' ' A' ' 94' ' ' CYS . 14.0 p -49.44 -36.63 10.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.211 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -78.2 5.92 52.7 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.525 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.17 119.44 37.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.854 0.359 . . . . 0.0 110.961 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -94.83 146.91 23.88 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.165 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . 0.468 ' CE2' ' OD1' ' A' ' 68' ' ' ASP . 3.0 p90 -146.86 121.84 10.04 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.91 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.13 148.91 25.88 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.814 179.883 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.414 ' O ' ' HG2' ' A' ' 85' ' ' LYS . 0.0 OUTLIER -152.52 118.63 3.03 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.002 179.963 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.433 ' HA ' ' HA ' ' A' ' 89' ' ' ILE . 50.5 Cg_exo -53.81 85.93 0.03 OUTLIER 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 122.706 2.271 . . . . 0.0 112.22 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.452 ' O ' ' N ' ' A' ' 87' ' ' SER . 8.4 mmtm -87.59 160.94 18.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.976 -179.839 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 49.7 m-20 45.37 -92.02 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.022 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . 0.452 ' N ' ' O ' ' A' ' 85' ' ' LYS . 1.4 m -143.83 20.65 1.81 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.963 -179.935 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 10.6 ttm -152.03 173.33 15.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.795 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.451 ' O ' ' HA ' ' A' ' 106' ' ' ILE . 1.8 mt -101.22 125.95 55.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.143 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' TRP . . . . . 0.622 ' CD1' ' N ' ' A' ' 90' ' ' TRP . 0.2 OUTLIER -126.14 130.29 50.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.854 -179.937 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.46 ' N ' ' O ' ' A' ' 105' ' ' THR . 24.7 t0 -65.59 63.61 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.838 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . 0.47 ' HA ' ' HA ' ' A' ' 104' ' ' CYS . 8.3 m -51.13 93.38 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.991 -179.91 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.475 ' N ' ' O ' ' A' ' 103' ' ' SER . 0.2 OUTLIER -82.9 130.26 35.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.021 179.936 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.441 ' O ' ' HA ' ' A' ' 77' ' ' VAL . 0.7 OUTLIER -75.91 56.89 1.0 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.997 -179.847 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.466 HG13 ' HB ' ' A' ' 93' ' ' THR . 2.0 mt -73.54 72.62 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.12 179.96 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -127.74 84.29 0.33 Allowed Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.563 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -121.99 80.71 1.73 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.852 0.358 . . . . 0.0 111.054 179.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 113.72 6.75 20.94 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.398 -179.835 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -164.86 -60.55 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.837 0.351 . . . . 0.0 110.854 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 114.45 80.19 0.91 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.475 -179.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.92 102.53 7.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.791 0.329 . . . . 0.0 110.942 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.57 ' N ' HD13 ' A' ' 102' ' ' ILE . 2.5 mm -85.1 76.36 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.159 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.475 ' O ' ' N ' ' A' ' 93' ' ' THR . 3.3 t -63.24 135.51 57.13 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.935 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.47 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 39.4 m -124.73 152.63 43.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.818 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . 0.46 ' O ' ' N ' ' A' ' 91' ' ' ASP . 2.7 t -162.11 141.28 9.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.157 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.451 ' HA ' ' O ' ' A' ' 89' ' ' ILE . 0.8 OUTLIER -68.06 149.0 11.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.064 179.846 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -156.87 136.71 12.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.154 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -112.34 114.55 27.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.959 -179.915 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 11.0 mmt180 . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.153 -0.927 . . . . 0.0 110.899 179.856 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo . . . . . 0 N--CA 1.464 -0.248 0 CA-C-O 120.756 0.232 . . . . 0.0 112.436 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 119.82 168.44 13.86 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.706 179.958 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 98.0 m -118.42 109.85 16.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.806 0.336 . . . . 0.0 110.84 179.924 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 79.5 t80 -96.67 116.32 28.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.954 -179.904 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -159.22 153.51 23.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.885 -179.971 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.427 ' CG ' ' O ' ' A' ' 24' ' ' ASN . 23.7 t-20 55.89 33.65 22.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.896 179.998 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 68.42 12.8 64.29 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.555 -179.982 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.483 ' HB3' ' CE1' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -123.07 140.57 52.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.834 0.35 . . . . 0.0 110.918 179.983 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 5.6 t-160 -116.1 91.86 3.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.003 -179.826 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.582 ' CE2' ' CE2' ' A' ' 34' ' ' TRP . 0.1 OUTLIER -81.2 -179.2 7.25 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.019 179.932 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.519 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 0.0 OUTLIER -110.42 145.08 38.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.835 179.946 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.668 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.7 mp -41.26 148.27 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.395 -179.898 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.423 ' HB2' ' O ' ' A' ' 30' ' ' ILE . 71.5 m-80 66.63 12.92 9.09 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.136 179.801 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.519 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 56.1 tt0 -101.67 155.62 18.0 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.014 0.435 . . . . 0.0 111.23 -179.973 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.485 ' HG2' ' OG1' ' A' ' 46' ' ' THR . 23.2 mt-30 -119.34 158.83 25.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.632 179.944 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . 0.585 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 43.8 p90 -162.95 176.07 10.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.03 -179.964 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -107.11 113.69 27.3 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.087 -179.872 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.517 ' N ' ' O ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -97.48 178.18 5.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.805 179.92 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -147.39 140.58 25.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.667 -179.796 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 11.7 t80 -160.12 140.07 11.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.729 179.808 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 57.0 23.85 8.82 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.784 -179.879 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 75.52 32.86 53.95 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.888 -0.673 . . . . 0.0 112.747 179.819 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.454 ' O ' HD13 ' A' ' 43' ' ' LEU . 91.0 m-20 -136.38 148.36 47.79 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 120.875 0.369 . . . . 0.0 110.984 179.796 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.612 ' O ' HD12 ' A' ' 43' ' ' LEU . . . -71.65 133.82 45.94 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.767 179.841 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.612 HD12 ' O ' ' A' ' 42' ' ' ALA . 10.0 mp -126.44 153.34 45.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.358 -179.649 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.469 ' O ' ' HB3' ' A' ' 56' ' ' CYS . 2.2 t -113.02 124.14 69.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.026 -0.534 . . . . 0.0 109.904 179.033 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.585 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 9.4 m -113.28 161.71 16.89 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.902 -178.838 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.485 ' OG1' ' HG2' ' A' ' 33' ' ' GLN . 55.2 m -151.63 109.87 3.74 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.664 179.638 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.555 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 16.9 t -66.83 145.22 55.72 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.971 -179.765 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.484 ' CE1' ' O ' ' A' ' 46' ' ' THR . 4.0 m-85 -115.47 -42.51 3.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.852 -179.956 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 149.32 41.16 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.422 -179.901 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 49.42 47.49 35.6 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.487 -179.958 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 71.1 p -156.04 -58.9 0.1 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.841 0.353 . . . . 0.0 110.785 -179.977 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 13.7 mtp180 -75.96 1.17 16.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.078 179.984 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 62.35 116.89 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.743 -0.742 . . . . 0.0 112.519 179.948 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.567 ' CG ' ' O ' ' A' ' 54' ' ' PHE . 15.1 p90 -56.47 99.03 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.832 0.348 . . . . 0.0 110.836 179.976 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -72.45 140.56 48.36 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.955 -179.919 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.496 ' SG ' ' CD2' ' A' ' 54' ' ' PHE . 2.3 m -145.99 175.18 10.64 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.933 -179.916 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -171.03 -174.17 1.46 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.918 -179.95 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.414 ' O ' ' C ' ' A' ' 59' ' ' LYS . 5.0 p -79.77 136.24 36.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.876 179.993 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.414 ' C ' ' O ' ' A' ' 58' ' ' SER . 0.0 OUTLIER . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.902 -179.927 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.455 -0.219 0 CA-C-O 120.843 0.354 . . . . 0.0 110.697 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.481 ' C ' HG22 ' A' ' 65' ' ' THR . 3.0 tt0 -73.62 88.09 1.68 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.887 -179.888 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.496 ' OG1' ' N ' ' A' ' 66' ' ' CYS . 0.5 OUTLIER -168.58 176.63 5.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.079 179.918 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.496 ' N ' ' OG1' ' A' ' 65' ' ' THR . 0.1 OUTLIER 177.53 -66.07 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.923 -179.949 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.438 ' O ' ' N ' ' A' ' 69' ' ' LYS . 46.2 t80 63.28 74.82 0.41 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.951 179.935 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . 0.514 ' O ' ' N ' ' A' ' 72' ' ' GLY . 15.0 t70 -41.27 95.19 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.85 179.982 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.438 ' N ' ' O ' ' A' ' 67' ' ' PHE . 2.2 pttm -57.11 -17.41 10.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.916 -179.926 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -65.84 -56.27 12.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.102 -179.866 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.99 7.04 14.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.277 -179.904 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . 0.514 ' N ' ' O ' ' A' ' 68' ' ' ASP . . . 59.77 31.62 72.15 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.382 179.947 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -84.05 -172.96 4.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.852 0.358 . . . . 0.0 110.773 179.93 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 15.8 m -111.03 79.06 1.16 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.968 179.925 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.456 ' CD2' ' HB2' ' A' ' 68' ' ' ASP . 11.1 m-30 -89.46 169.56 11.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.893 -179.99 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . 0.426 ' NE ' ' OE2' ' A' ' 64' ' ' GLU . 0.0 OUTLIER -128.01 135.97 50.63 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.766 -179.966 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.454 ' HA ' ' O ' ' A' ' 94' ' ' CYS . 2.3 p -48.53 -26.53 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.945 -179.965 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -90.1 8.25 80.14 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.513 -179.955 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -125.43 127.51 46.64 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.849 0.357 . . . . 0.0 110.787 179.966 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 5.0 t -103.35 150.8 23.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.148 -179.874 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . 0.498 ' CG ' ' O ' ' A' ' 81' ' ' TYR . 25.9 p90 -140.84 112.09 7.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.824 179.844 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.486 ' CB ' ' OD1' ' A' ' 91' ' ' ASP . 6.1 pt-20 -86.12 136.12 33.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.974 -179.835 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.442 ' HA ' ' HD2' ' A' ' 84' ' ' PRO . 4.4 mtt180 -110.59 106.79 58.04 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.815 -179.991 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.451 ' HA ' HG12 ' A' ' 89' ' ' ILE . 34.0 Cg_endo -64.62 88.35 0.17 Allowed 'Trans proline' 0 C--O 1.231 0.156 0 C-N-CA 122.784 2.323 . . . . 0.0 112.283 179.983 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 2.4 mttm -126.74 126.32 43.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.934 179.995 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.491 ' CB ' ' SD ' ' A' ' 88' ' ' MET . 0.4 OUTLIER 67.92 177.42 0.25 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.841 179.905 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.2 m -84.99 55.58 3.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.945 -179.987 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . 0.491 ' SD ' ' CB ' ' A' ' 86' ' ' ASP . 0.0 OUTLIER -150.23 -47.41 0.13 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.83 -179.947 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.484 ' C ' ' CD1' ' A' ' 90' ' ' TRP . 35.6 mt 62.76 137.4 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.839 179.97 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 90' ' ' TRP . . . . . 0.604 ' CD1' ' N ' ' A' ' 90' ' ' TRP . 0.1 OUTLIER -142.67 124.55 15.16 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.934 -179.881 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.486 ' OD1' ' CB ' ' A' ' 82' ' ' GLU . 93.8 m-20 -75.21 72.89 2.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.939 179.983 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . 0.476 ' HA ' ' O ' ' A' ' 103' ' ' SER . 0.1 OUTLIER -52.34 99.19 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.956 179.879 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 2.5 m -80.88 127.92 33.09 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.008 179.903 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.672 ' HA ' HD12 ' A' ' 102' ' ' ILE . 1.8 t -70.49 72.55 0.5 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.989 -179.856 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 1.9 mt -67.99 149.12 11.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.162 179.97 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -159.92 -102.82 0.18 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.644 -179.947 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . 48.69 37.78 10.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.836 0.351 . . . . 0.0 111.019 -179.914 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 120.43 -38.42 2.74 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.506 179.999 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.22 99.78 6.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.769 0.318 . . . . 0.0 110.882 -179.926 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -69.96 77.62 0.41 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.433 179.93 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -120.8 93.73 4.12 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.805 0.336 . . . . 0.0 110.961 -179.983 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.672 HD12 ' HA ' ' A' ' 94' ' ' CYS . 6.6 mm -60.75 123.91 14.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.124 179.906 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.476 ' O ' ' HA ' ' A' ' 92' ' ' CYS . 25.3 t -105.93 125.81 51.44 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.991 -179.92 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.45 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 0.5 OUTLIER -102.27 86.5 2.84 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.962 -179.924 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 4.7 t -73.12 131.75 42.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.113 179.918 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.575 ' HB ' ' CZ3' ' A' ' 90' ' ' TRP . 0.9 OUTLIER -62.87 148.78 10.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.959 179.794 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.451 ' HB3' ' O ' ' A' ' 88' ' ' MET . . . -77.6 168.52 19.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.019 179.941 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -175.54 145.1 0.71 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.891 -179.961 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 4.1 mtt180 . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.855 -179.98 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_exo . . . . . 0 C--O 1.232 0.178 0 CA-C-O 120.755 0.231 . . . . 0.0 112.256 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . 0.527 ' H ' HD11 ' A' ' 30' ' ' ILE . . . 82.33 122.87 0.72 Allowed Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.572 179.947 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.483 ' O ' ' HB2' ' A' ' 22' ' ' TYR . 11.7 m -79.49 -179.91 7.09 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.83 0.347 . . . . 0.0 110.752 179.781 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.483 ' HB2' ' O ' ' A' ' 21' ' ' CYS . 85.7 t80 174.93 119.35 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.919 179.942 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -153.95 156.89 38.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.856 -179.996 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.4 ' CG ' ' O ' ' A' ' 24' ' ' ASN . 29.3 t-20 48.35 27.47 1.37 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.88 -179.943 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.06 -3.55 70.56 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.523 179.965 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.586 ' HB3' ' CZ ' ' A' ' 28' ' ' TYR . 0.9 OUTLIER -91.95 135.52 33.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.837 0.351 . . . . 0.0 110.852 -179.986 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 3.9 t-160 -113.47 90.82 3.44 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.997 -179.984 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.586 ' CZ ' ' HB3' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -84.98 142.61 29.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.988 179.938 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.526 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 6.7 mt-30 -76.39 147.0 38.32 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.587 179.771 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.828 HD13 ' SG ' ' A' ' 47' ' ' CYS . 7.6 mm -49.5 147.59 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.961 0.41 . . . . 0.0 110.982 179.979 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.431 ' CG ' HG22 ' A' ' 30' ' ' ILE . 61.3 m-20 67.1 7.77 5.67 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.042 179.956 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.526 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 1.5 tt0 -92.76 151.79 19.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.849 0.356 . . . . 0.0 110.9 179.932 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -124.8 136.54 53.92 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.043 -179.826 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . 0.595 ' CZ3' ' HB2' ' A' ' 47' ' ' CYS . 19.3 p90 -134.86 -170.96 2.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.759 179.876 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.5 ' HG3' HG22 ' A' ' 44' ' ' VAL . 2.2 mt-10 -130.76 125.17 33.12 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.922 0.391 . . . . 0.0 111.159 -179.868 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.47 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 0.1 OUTLIER -122.85 172.89 8.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.74 179.742 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -126.37 143.94 51.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.757 -179.769 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -155.92 125.45 6.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.611 179.769 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 74.36 14.61 3.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.522 -179.879 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 80.01 45.49 8.27 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.611 -179.957 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 7.5 m-80 -149.46 168.33 23.74 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 120.789 0.328 . . . . 0.0 110.995 179.865 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.783 ' C ' HD12 ' A' ' 43' ' ' LEU . . . -82.82 132.08 35.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.953 179.805 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.783 HD12 ' C ' ' A' ' 42' ' ' ALA . 10.3 mp -136.52 146.28 46.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.972 0.415 . . . . 0.0 111.311 -179.718 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.5 HG22 ' HG3' ' A' ' 35' ' ' GLU . 2.4 t -114.74 130.6 68.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.139 179.05 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.593 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 1.3 m -112.06 166.54 11.15 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.096 0.474 . . . . 0.0 111.537 -179.323 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.467 ' O ' ' HB2' ' A' ' 54' ' ' PHE . 27.9 m -143.52 147.56 34.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.663 -0.698 . . . . 0.0 110.69 179.704 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.828 ' SG ' HD13 ' A' ' 30' ' ' ILE . 21.9 t -106.88 143.91 34.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.937 -179.825 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.44 ' CD1' ' N ' ' A' ' 48' ' ' TYR . 3.1 m-85 -130.37 -47.08 1.08 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.919 179.906 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 99.91 -50.22 1.12 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.793 -0.718 . . . . 0.0 112.428 -179.921 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -70.46 -152.88 0.91 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.486 179.913 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.12 -6.14 45.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.7 0.286 . . . . 0.0 111.016 179.986 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 1.3 mtt180 -62.68 -38.25 89.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.106 -179.932 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 61.42 155.82 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.657 -0.782 . . . . 0.0 112.303 -179.887 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.558 ' CE1' ' SG ' ' A' ' 45' ' ' CYS . 0.2 OUTLIER -72.88 126.59 30.29 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.794 0.33 . . . . 0.0 110.818 -179.966 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 43.9 m-80 -120.47 118.27 29.84 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.767 179.97 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.49 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.1 OUTLIER -89.28 167.27 13.2 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.061 -179.837 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -151.24 151.04 31.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.836 179.938 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.462 ' O ' ' O ' ' A' ' 59' ' ' LYS . 4.9 p -72.19 77.94 0.97 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.968 -179.933 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.462 ' O ' ' O ' ' A' ' 58' ' ' SER . 12.3 tptt . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.048 179.883 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.454 -0.256 0 CA-C-O 120.783 0.325 . . . . 0.0 110.481 . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.507 ' HB3' HG11 ' A' ' 77' ' ' VAL . 1.8 mp0 -151.53 122.31 7.52 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.964 -179.866 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.459 ' O ' ' HA3' ' A' ' 96' ' ' GLY . 0.0 OUTLIER -173.91 -172.01 0.69 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.0 179.96 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.459 ' O ' HG23 ' A' ' 74' ' ' THR . 1.7 p -171.5 171.47 5.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.961 179.959 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -160.6 106.74 1.49 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.027 179.998 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 50.2 t0 -70.44 88.05 0.65 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.825 179.965 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.426 ' O ' ' C ' ' A' ' 70' ' ' TYR . 0.5 OUTLIER -59.35 -37.44 77.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.997 -179.975 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . 0.426 ' C ' ' O ' ' A' ' 69' ' ' LYS . 10.5 m-30 -36.13 -40.57 0.22 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.863 179.949 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 91.2 m -121.58 -30.45 4.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.138 179.88 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 107.18 14.14 19.39 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.37 -179.924 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 15.4 m-20 -92.73 176.81 6.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.923 0.392 . . . . 0.0 110.967 179.981 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.459 HG23 ' O ' ' A' ' 66' ' ' CYS . 90.0 m -132.85 136.41 46.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.959 179.88 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.459 ' CD2' ' CE2' ' A' ' 81' ' ' TYR . 34.7 m-85 -128.38 -170.72 2.3 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.74 -179.972 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 31.1 mtt-85 -99.18 124.52 44.3 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.808 179.921 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.507 HG11 ' HB3' ' A' ' 64' ' ' GLU . 7.3 p -54.0 -27.27 15.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.169 -179.93 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -79.83 -4.99 89.63 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.578 -179.979 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -123.17 -174.52 2.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.833 0.349 . . . . 0.0 110.98 -179.989 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 13.6 t -144.63 -174.68 4.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.979 -179.98 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . 0.459 ' CE2' ' CD2' ' A' ' 75' ' ' TYR . 33.3 p90 -159.92 153.85 23.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.952 179.963 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 54.4 tt0 -82.88 140.77 32.69 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.875 179.98 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.43 110.43 9.7 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.971 -179.883 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -74.32 98.36 1.1 Allowed 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 122.736 2.291 . . . . 0.0 112.381 179.977 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.402 ' O ' ' CB ' ' A' ' 86' ' ' ASP . 0.1 OUTLIER -131.55 123.26 27.59 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.91 -179.993 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.402 ' CB ' ' O ' ' A' ' 85' ' ' LYS . 2.6 t0 77.31 -155.18 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.924 179.954 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 59.3 p -85.26 -3.24 58.75 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.125 179.925 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 2.7 tpt -128.09 163.91 23.58 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.889 -179.949 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.514 ' C ' ' CD1' ' A' ' 90' ' ' TRP . 2.3 mp -106.23 152.45 7.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.052 179.88 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 90' ' ' TRP . . . . . 0.618 ' CD1' ' N ' ' A' ' 90' ' ' TRP . 0.1 OUTLIER -143.81 141.81 30.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.963 -179.986 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -91.34 70.85 6.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.924 179.963 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . 0.426 ' HA ' ' HA ' ' A' ' 104' ' ' CYS . 72.1 m -47.9 99.95 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.039 -179.958 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.513 ' O ' HG23 ' A' ' 102' ' ' ILE . 0.2 OUTLIER -71.26 122.29 19.97 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.879 179.896 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -63.76 86.47 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.938 -179.84 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.833 HG22 ' CA ' ' A' ' 100' ' ' GLY . 1.1 mt -100.0 102.11 13.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.147 -179.948 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . 0.624 ' O ' ' HB3' ' A' ' 97' ' ' ALA . . . -112.08 -136.53 6.86 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.706 -179.969 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.624 ' HB3' ' O ' ' A' ' 96' ' ' GLY . . . 79.76 -157.46 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.632 0.253 . . . . 0.0 110.875 -179.776 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -42.36 -30.83 0.87 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.515 -0.85 . . . . 0.0 112.204 179.871 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.51 ' O ' ' N ' ' A' ' 101' ' ' ARG . 3.9 ttp180 -155.69 -55.03 0.09 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.846 0.355 . . . . 0.0 110.377 179.824 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 0.833 ' CA ' HG22 ' A' ' 95' ' ' ILE . . . 58.14 -75.22 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.952 -0.642 . . . . 0.0 112.779 179.667 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.521 ' CD ' ' O ' ' A' ' 101' ' ' ARG . 0.0 OUTLIER 69.11 87.07 0.12 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.831 0.348 . . . . 0.0 110.494 -179.733 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.599 ' H ' HD12 ' A' ' 102' ' ' ILE . 3.7 mp -41.2 122.13 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.18 179.96 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.475 ' HB2' ' NH2' ' A' ' 101' ' ' ARG . 19.5 t -105.38 133.01 50.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.929 -179.913 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.426 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 38.3 m -112.32 132.1 55.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.883 179.902 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . 0.412 ' O ' ' HA ' ' A' ' 90' ' ' TRP . 5.0 t -140.72 143.67 35.14 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.216 -179.931 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.466 ' HA ' ' O ' ' A' ' 89' ' ' ILE . 5.8 mt -47.91 155.24 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.902 179.919 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.429 ' N ' ' CG2' ' A' ' 106' ' ' ILE . . . -90.59 111.95 23.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.059 -179.99 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -92.65 154.52 18.32 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.863 -179.941 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 15.1 ptt85 . . . . . 0 C--O 1.248 0.985 0 CA-C-O 118.273 -0.87 . . . . 0.0 110.875 -179.919 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.433 ' HB2' HD11 ' A' ' 30' ' ' ILE . 32.5 Cg_exo . . . . . 0 C--O 1.231 0.132 0 CA-C-O 120.854 0.273 . . . . 0.0 112.178 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 152.18 -162.06 29.64 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.514 -179.976 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 17.1 m -152.67 97.92 2.29 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.916 0.388 . . . . 0.0 110.819 179.979 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -71.83 135.21 46.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.982 -179.986 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.411 ' HB3' ' ND2' ' A' ' 24' ' ' ASN . 0.2 OUTLIER -157.48 121.98 4.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.95 179.995 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.411 ' ND2' ' HB3' ' A' ' 23' ' ' ASP . 3.1 p30 44.62 47.42 8.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.048 179.934 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 71.11 2.17 45.79 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.638 179.924 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.403 ' HB3' ' CZ ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -103.26 133.33 48.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.834 0.349 . . . . 0.0 110.906 179.961 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -116.73 91.94 3.73 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.963 -179.769 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.598 ' CE2' ' CE2' ' A' ' 34' ' ' TRP . 3.2 m-85 -79.79 130.52 35.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.946 -179.955 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.47 ' O ' ' HB2' ' A' ' 32' ' ' GLN . 3.2 tt0 -63.25 135.05 56.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.599 179.891 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.717 HG23 ' C ' ' A' ' 48' ' ' TYR . 4.2 mp -31.85 139.07 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.512 -179.924 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.476 ' N ' ' O ' ' A' ' 47' ' ' CYS . 61.0 m-20 78.11 0.74 2.72 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.124 -179.78 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.47 ' HB2' ' O ' ' A' ' 29' ' ' GLN . 6.3 mm100 -76.94 141.71 40.36 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.819 0.342 . . . . 0.0 110.885 179.81 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . 0.487 ' HG2' HG23 ' A' ' 46' ' ' THR . 11.4 mt-30 -114.13 132.33 56.1 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.037 -179.962 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . 0.598 ' CE2' ' CE2' ' A' ' 28' ' ' TYR . 42.6 p90 -148.61 -168.46 3.1 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.921 -179.935 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -122.44 132.78 54.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.967 -179.799 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 1.0 ' O ' HD22 ' A' ' 43' ' ' LEU . 0.4 OUTLIER -119.95 167.56 12.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.773 179.879 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.776 HG22 ' O ' ' A' ' 41' ' ' ASN . 0.1 OUTLIER -109.43 164.23 12.69 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.086 -179.86 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.582 ' HB2' HD21 ' A' ' 43' ' ' LEU . 0.1 OUTLIER -156.14 93.01 1.39 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.651 179.91 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.45 HD13 ' HA ' ' A' ' 39' ' ' LEU . 0.8 OUTLIER 67.2 18.59 10.36 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.694 -179.707 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 107.11 8.97 30.67 Favored Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.62 179.996 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.776 ' O ' HG22 ' A' ' 37' ' ' THR . 50.1 m-80 -94.78 -173.11 2.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.852 0.358 . . . . 0.0 111.018 -179.908 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.957 ' C ' HD13 ' A' ' 43' ' ' LEU . . . -135.48 107.83 7.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.924 179.844 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 1.0 HD22 ' O ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -121.89 157.59 30.85 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.156 -179.889 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.467 ' O ' ' HB3' ' A' ' 56' ' ' CYS . 2.8 t -95.8 132.09 40.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.176 -0.466 . . . . 0.0 109.934 179.122 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.54 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 1.8 m -114.29 157.17 23.12 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.738 -179.092 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.487 HG23 ' HG2' ' A' ' 33' ' ' GLN . 4.6 m -146.18 130.81 17.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.599 179.545 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.51 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 20.0 t -83.79 139.16 32.87 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.029 -179.644 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.717 ' C ' HG23 ' A' ' 30' ' ' ILE . 5.5 m-85 -119.56 -14.93 9.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.967 -179.925 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.517 ' HA2' ' CG1' ' A' ' 30' ' ' ILE . . . 132.09 -165.22 23.6 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.557 179.94 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . 0.514 ' O ' ' CB ' ' A' ' 51' ' ' SER . . . -91.98 67.09 2.12 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.534 -179.977 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . 0.514 ' CB ' ' O ' ' A' ' 50' ' ' GLY . 0.1 OUTLIER 159.66 -51.73 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.756 0.312 . . . . 0.0 110.908 179.99 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 9.5 mtt-85 -57.27 -19.08 19.54 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.904 179.925 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . 0.472 ' O ' ' CD1' ' A' ' 48' ' ' TYR . . . 73.54 172.46 24.76 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.597 179.832 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.577 ' CG ' ' O ' ' A' ' 54' ' ' PHE . 11.3 p90 -114.23 96.59 5.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.828 0.346 . . . . 0.0 110.838 179.989 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 61.0 m-20 -71.14 138.31 49.54 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.708 179.991 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.506 ' SG ' ' CD2' ' A' ' 54' ' ' PHE . 3.0 m -144.2 162.11 37.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.942 0.401 . . . . 0.0 111.231 -179.648 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . 0.458 ' O ' ' O ' ' A' ' 58' ' ' SER . 0.5 OUTLIER -162.72 160.9 26.03 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.771 179.857 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . 0.458 ' O ' ' O ' ' A' ' 57' ' ' GLU . 0.6 OUTLIER -37.3 161.01 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.945 179.993 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.034 -179.932 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 . . . . . 0 N--CA 1.454 -0.231 0 CA-C-O 120.824 0.345 . . . . 0.0 110.609 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.762 ' O ' HG23 ' A' ' 65' ' ' THR . 5.8 tt0 66.26 114.37 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.921 179.86 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.762 HG23 ' O ' ' A' ' 64' ' ' GLU . 0.2 OUTLIER 171.82 169.33 0.1 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.195 179.985 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.442 ' HB2' ' C ' ' A' ' 75' ' ' TYR . 0.8 OUTLIER -153.05 -175.09 5.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.783 179.98 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -129.78 -37.22 1.55 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.943 -179.928 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . 0.445 ' O ' ' O ' ' A' ' 69' ' ' LYS . 27.3 t0 59.98 63.99 1.35 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.806 179.997 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.445 ' O ' ' O ' ' A' ' 68' ' ' ASP . 9.7 ptmt -45.44 176.07 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.882 179.98 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . 0.872 ' O ' HG23 ' A' ' 71' ' ' THR . 20.4 m-85 65.37 17.78 11.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.955 -179.997 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.872 HG23 ' O ' ' A' ' 70' ' ' TYR . 0.7 OUTLIER -177.75 -34.47 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.218 -179.994 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 80.04 42.62 10.64 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.553 -179.991 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . 0.409 ' O ' ' CB ' ' A' ' 68' ' ' ASP . 0.1 OUTLIER -100.58 116.12 31.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.791 0.329 . . . . 0.0 110.855 179.97 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.43 ' O ' ' NH2' ' A' ' 76' ' ' ARG . 5.2 m -70.61 100.47 1.84 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.101 179.957 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.442 ' C ' ' HB2' ' A' ' 66' ' ' CYS . 3.9 m-30 -92.29 -174.49 3.74 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.853 -179.953 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . 0.43 ' NH2' ' O ' ' A' ' 74' ' ' THR . 0.6 OUTLIER -129.69 157.71 41.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.808 179.938 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.489 ' HB ' ' HG3' ' A' ' 64' ' ' GLU . 75.7 t -63.67 -20.57 26.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.136 179.941 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -91.18 31.0 5.91 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.461 179.933 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -148.9 148.44 29.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.882 0.372 . . . . 0.0 111.114 179.971 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.776 HG22 HG23 ' A' ' 93' ' ' THR . 80.6 p -125.39 169.61 12.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.026 179.974 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . 0.478 ' OH ' HG21 ' A' ' 102' ' ' ILE . 11.0 p90 -174.29 134.92 0.43 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.936 179.96 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.419 ' HG3' ' HA ' ' A' ' 91' ' ' ASP . 11.6 mp0 -87.82 165.39 15.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.968 -179.996 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . 0.512 ' NE ' ' HD2' ' A' ' 84' ' ' PRO . 0.0 OUTLIER -148.3 113.13 3.8 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.772 179.966 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.512 ' HD2' ' NE ' ' A' ' 83' ' ' ARG . 37.4 Cg_endo -66.2 74.1 0.36 Allowed 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.699 2.266 . . . . 0.0 112.254 179.986 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.565 ' HE2' ' CE2' ' A' ' 70' ' ' TYR . 4.9 mmtt -100.08 131.06 46.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.871 -179.959 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 9.5 t0 57.23 -173.85 0.08 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.778 179.962 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . 0.456 ' O ' ' HB2' ' A' ' 88' ' ' MET . 8.5 m -72.48 58.58 0.41 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.958 179.967 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . 0.456 ' HB2' ' O ' ' A' ' 87' ' ' SER . 1.9 ttm 176.48 166.93 0.47 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.859 -179.999 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 1.9 mp -123.84 146.18 29.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.108 179.989 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 90' ' ' TRP . . . . . 0.623 ' CD1' ' N ' ' A' ' 90' ' ' TRP . 0.0 OUTLIER -137.09 139.17 41.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.811 -179.941 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.419 ' HA ' ' HG3' ' A' ' 82' ' ' GLU . 6.0 m-20 -77.91 63.36 2.91 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.757 179.889 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . 0.444 ' HA ' ' O ' ' A' ' 103' ' ' SER . 3.8 m -44.88 112.52 0.44 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.163 -179.895 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.776 HG23 HG22 ' A' ' 80' ' ' THR . 0.9 OUTLIER -96.48 143.49 27.45 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.78 179.771 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . 0.424 ' SG ' ' O ' ' A' ' 76' ' ' ARG . 3.5 t -74.58 81.44 1.99 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.047 -179.822 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.557 HD12 ' HB2' ' A' ' 103' ' ' SER . 2.6 mt -101.51 145.11 12.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.209 179.987 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 116.05 146.43 8.67 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.499 -179.914 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -89.27 45.32 1.28 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.806 0.336 . . . . 0.0 111.154 -179.91 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . 0.405 ' O ' ' HB2' ' A' ' 99' ' ' ARG . . . 142.05 -9.45 2.5 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.649 179.849 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.518 ' O ' ' N ' ' A' ' 101' ' ' ARG . 0.9 OUTLIER 173.6 -40.84 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.782 0.325 . . . . 0.0 110.936 -179.983 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 0.404 ' C ' ' O ' ' A' ' 99' ' ' ARG . . . 38.16 -91.5 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.384 -179.958 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.518 ' N ' ' O ' ' A' ' 99' ' ' ARG . 0.0 OUTLIER -179.03 33.68 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.748 0.309 . . . . 0.0 110.982 179.758 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.478 HG21 ' OH ' ' A' ' 81' ' ' TYR . 3.2 mt 28.55 89.26 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.671 179.756 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.557 ' HB2' HD12 ' A' ' 95' ' ' ILE . 1.4 t -55.78 148.49 16.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.868 179.941 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.447 ' SG ' ' O ' ' A' ' 103' ' ' SER . 18.5 m -157.17 142.82 17.52 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.973 -179.939 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -162.18 134.61 5.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.069 179.996 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.578 HG13 ' CE3' ' A' ' 90' ' ' TRP . 3.5 mt -51.15 142.12 3.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.086 179.887 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -63.0 170.22 2.87 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.126 179.929 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -96.87 95.19 7.69 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.945 179.999 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.247 -0.883 . . . . 0.0 110.924 179.969 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo . . . . . 0 N--CA 1.464 -0.237 0 CA-C-O 120.874 0.281 . . . . 0.0 112.522 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' GLY . . . . . 0.556 ' HA2' HD11 ' A' ' 30' ' ' ILE . . . 79.51 159.8 17.93 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.623 179.791 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.479 ' O ' ' CD2' ' A' ' 27' ' ' HIS . 1.6 m -92.03 174.3 7.39 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.743 0.306 . . . . 0.0 110.921 179.936 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 85.3 t80 177.61 143.98 0.1 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.864 -179.976 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 166.66 169.7 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.87 179.977 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.418 ' CG ' ' O ' ' A' ' 24' ' ' ASN . 35.1 t30 54.09 24.34 4.73 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.902 179.927 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 77.4 6.73 86.76 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.576 179.94 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.585 ' HB3' ' CE1' ' A' ' 28' ' ' TYR . 2.1 ttpt -119.74 149.48 41.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.75 0.309 . . . . 0.0 110.876 -179.985 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . 0.479 ' CD2' ' O ' ' A' ' 21' ' ' CYS . 3.0 t-160 -116.51 96.42 5.51 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.109 -179.834 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.585 ' CE1' ' HB3' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -90.73 171.53 9.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.96 -179.995 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.486 ' O ' ' HB2' ' A' ' 32' ' ' GLN . 0.1 OUTLIER -95.17 173.88 7.34 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.905 179.934 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.676 HD12 ' HA2' ' A' ' 49' ' ' GLY . 33.5 mm -72.45 148.41 9.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.166 -179.989 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 65.6 m-20 64.24 10.73 5.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.852 -179.918 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.486 ' HB2' ' O ' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -88.78 158.31 18.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.784 -179.999 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -119.29 138.59 52.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.956 -179.87 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . 0.563 ' CE2' ' HB2' ' A' ' 45' ' ' CYS . 37.2 p90 -149.59 -179.77 7.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.037 -179.904 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.49 ' HG2' ' O ' ' A' ' 43' ' ' LEU . 3.9 tt0 -117.58 128.82 55.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.577 -179.991 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 36' ' ' ARG . . . . . 0.993 ' O ' HD22 ' A' ' 43' ' ' LEU . 2.9 ttt180 -114.82 169.79 8.82 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.811 0.338 . . . . 0.0 110.965 -179.985 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.1 m -130.05 130.48 44.97 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.644 -179.916 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -147.74 143.78 27.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.791 179.85 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.501 HD13 ' HA ' ' A' ' 39' ' ' LEU . 0.5 OUTLIER 51.24 35.28 13.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.681 -179.838 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 66.95 38.8 93.07 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.827 -0.701 . . . . 0.0 112.494 -179.89 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 36.3 m-20 -134.87 179.77 6.1 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 120.856 0.36 . . . . 0.0 110.934 -179.93 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.886 ' C ' HD13 ' A' ' 43' ' ' LEU . . . -125.67 118.75 26.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.988 179.859 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.993 HD22 ' O ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -124.9 163.67 21.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.961 0.41 . . . . 0.0 111.347 -179.871 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 44' ' ' VAL . . . . . 0.476 ' HA ' ' HA ' ' A' ' 35' ' ' GLU . 2.4 t -111.97 125.06 69.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.092 179.163 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.563 ' HB2' ' CE2' ' A' ' 34' ' ' TRP . 89.0 m -103.66 163.75 12.11 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.789 -178.874 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.445 ' O ' ' HA ' ' A' ' 54' ' ' PHE . 21.1 m -146.13 119.28 8.85 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.601 179.708 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.539 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 13.4 t -79.06 154.94 29.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.128 -179.61 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.423 ' C ' HG23 ' A' ' 30' ' ' ILE . 15.4 m-85 -123.49 -47.66 1.97 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.851 179.908 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . 0.676 ' HA2' HD12 ' A' ' 30' ' ' ILE . . . 119.22 139.21 5.95 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.418 -179.888 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 78.04 -111.3 3.22 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.747 179.874 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -117.86 -4.14 11.14 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.721 0.296 . . . . 0.0 111.152 -179.81 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 6.5 mtt180 -55.57 -26.14 41.9 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.985 -179.896 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 69.01 -173.65 34.83 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.536 179.908 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.579 ' CD1' ' O ' ' A' ' 54' ' ' PHE . 29.5 p90 -129.68 122.65 29.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.893 0.378 . . . . 0.0 111.007 -179.952 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -91.2 147.73 22.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.489 179.795 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.471 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.8 OUTLIER -137.35 156.51 48.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.926 0.393 . . . . 0.0 111.181 -179.834 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -144.59 133.56 22.63 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.797 179.923 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 22.9 t -37.43 130.52 0.95 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.057 179.972 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.87 179.899 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.619 ' HG3' ' HB1' ' A' ' 97' ' ' ALA . 1.2 tt0 . . . . . 0 N--CA 1.455 -0.196 0 CA-C-O 120.907 0.384 . . . . 0.0 110.505 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 64' ' ' GLU . . . . . 0.483 ' O ' HG23 ' A' ' 65' ' ' THR . 12.1 mt-10 -64.34 82.57 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.899 -179.77 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.483 HG23 ' O ' ' A' ' 64' ' ' GLU . 0.0 OUTLIER -177.24 166.32 2.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.192 179.899 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.467 ' O ' HG23 ' A' ' 74' ' ' THR . 0.8 OUTLIER -158.9 178.76 9.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.9 -179.817 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.437 ' O ' ' N ' ' A' ' 69' ' ' LYS . 44.8 t80 -131.49 85.04 2.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.883 179.985 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . 0.51 ' O ' ' N ' ' A' ' 72' ' ' GLY . 10.1 p-10 -53.65 86.83 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.964 179.994 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 69' ' ' LYS . . . . . 0.437 ' N ' ' O ' ' A' ' 67' ' ' PHE . 0.1 OUTLIER -40.32 -46.95 2.43 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.914 179.933 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . 0.411 ' C ' ' O ' ' A' ' 69' ' ' LYS . 8.7 m-30 -36.59 -74.94 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.954 179.928 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -93.79 -41.38 9.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.019 -179.976 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 72' ' ' GLY . . . . . 0.51 ' N ' ' O ' ' A' ' 68' ' ' ASP . . . 108.02 -3.44 33.61 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.661 -0.781 . . . . 0.0 112.468 -179.994 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . 0.492 ' OD1' ' N ' ' A' ' 73' ' ' ASN . 0.3 OUTLIER -73.21 102.57 3.67 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.836 0.351 . . . . 0.0 110.848 -179.982 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.467 HG23 ' O ' ' A' ' 66' ' ' CYS . 93.1 m -41.69 134.39 2.48 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.081 179.941 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 75' ' ' TYR . . . . . 0.421 ' HB2' ' SG ' ' A' ' 66' ' ' CYS . 14.3 m-85 -122.76 -174.26 2.88 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.739 179.959 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -117.7 149.46 40.7 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.804 179.94 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.452 ' CG1' ' HG2' ' A' ' 64' ' ' GLU . 9.6 p -63.08 -28.73 45.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.085 -179.991 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -91.69 11.13 72.99 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.518 179.872 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -126.07 153.9 43.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.836 0.351 . . . . 0.0 110.897 179.99 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.577 ' HB ' HG23 ' A' ' 93' ' ' THR . 0.1 OUTLIER -127.07 167.68 15.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.152 -179.883 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 81' ' ' TYR . . . . . 0.485 ' OH ' HG21 ' A' ' 102' ' ' ILE . 0.5 OUTLIER -149.56 154.1 38.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.885 -179.98 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -102.4 164.59 11.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.941 179.959 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 169.95 121.96 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.769 -179.998 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 84' ' ' PRO . . . . . 0.454 ' HA ' ' HA ' ' A' ' 89' ' ' ILE . 45.4 Cg_endo -68.45 161.49 44.7 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.73 2.287 . . . . 0.0 112.421 -179.962 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.432 ' O ' ' NE1' ' A' ' 90' ' ' TRP . 11.4 tptt 173.86 161.98 0.17 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.897 179.973 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 86' ' ' ASP . . . . . 0.489 ' O ' ' CB ' ' A' ' 87' ' ' SER . 1.1 m-20 56.81 19.97 4.84 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.934 -179.98 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . 0.489 ' CB ' ' O ' ' A' ' 86' ' ' ASP . 1.4 t 82.16 18.61 0.35 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.876 -179.993 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 88' ' ' MET . . . . . 0.621 ' SD ' HD11 ' A' ' 106' ' ' ILE . 5.6 ttm -162.2 172.68 15.39 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.958 -179.941 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 89' ' ' ILE . . . . . 0.507 ' C ' ' CD1' ' A' ' 90' ' ' TRP . 2.8 mt -96.75 141.85 14.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.054 179.912 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 90' ' ' TRP . . . . . 0.584 ' CE3' ' HB ' ' A' ' 106' ' ' ILE . 0.5 OUTLIER -142.89 84.61 1.85 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.84 -179.985 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -38.88 92.23 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.715 -179.935 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 92' ' ' CYS . . . . . 0.505 ' N ' ' O ' ' A' ' 90' ' ' TRP . 0.1 OUTLIER -81.73 129.29 34.67 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.013 -179.955 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.577 HG23 ' HB ' ' A' ' 80' ' ' THR . 63.3 m -114.8 135.66 53.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.086 179.905 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 6.7 t -59.6 88.67 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.097 -179.91 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 95' ' ' ILE . . . . . 0.479 HG13 ' O ' ' A' ' 93' ' ' THR . 1.3 mt -109.34 87.93 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.282 -179.874 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -176.76 -39.71 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.848 -0.692 . . . . 0.0 112.515 179.942 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 97' ' ' ALA . . . . . 0.619 ' HB1' ' HG3' ' A' ' 63' ' ' GLU . . . 62.68 35.04 14.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.842 0.353 . . . . 0.0 111.205 179.932 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 98' ' ' GLY . . . . . 0.442 ' O ' ' HD3' ' A' ' 99' ' ' ARG . . . 140.42 -10.52 2.97 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.59 -0.814 . . . . 0.0 112.677 179.952 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 99' ' ' ARG . . . . . 0.442 ' HD3' ' O ' ' A' ' 98' ' ' GLY . 0.2 OUTLIER 176.49 -83.29 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.805 0.336 . . . . 0.0 110.793 -179.899 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . 0.469 ' O ' ' HB3' ' A' ' 101' ' ' ARG . . . 35.54 -108.32 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.546 179.965 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 101' ' ' ARG . . . . . 0.564 ' N ' ' CD ' ' A' ' 101' ' ' ARG . 0.0 OUTLIER 176.95 104.59 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.841 0.353 . . . . 0.0 110.92 179.983 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.485 HG21 ' OH ' ' A' ' 81' ' ' TYR . 2.7 mp -52.2 116.42 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.222 179.986 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 103' ' ' SER . . . . . 0.473 ' O ' ' HA ' ' A' ' 92' ' ' CYS . 3.8 t -82.26 139.74 34.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.771 179.911 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 104' ' ' CYS . . . . . 0.403 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 0.5 OUTLIER -114.91 113.41 24.14 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.997 -179.875 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 1.4 p -97.02 109.4 22.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.048 179.809 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 106' ' ' ILE . . . . . 0.96 HD13 ' N ' ' A' ' 107' ' ' ALA . 0.0 OUTLIER -58.53 150.29 4.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.338 -179.927 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 107' ' ' ALA . . . . . 0.96 ' N ' HD13 ' A' ' 106' ' ' ILE . . . -99.98 126.84 46.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.946 179.822 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 -109.22 -13.25 14.68 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.036 -179.901 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.214 -0.898 . . . . 0.0 110.794 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 120.764 0.316 . . . . 0.0 111.154 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -171.89 131.26 0.72 Allowed Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.965 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -74.19 -165.48 0.27 Allowed 'Trans proline' 0 C--O 1.231 0.15 0 C-N-CA 122.818 2.345 . . . . 0.0 112.432 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 119.11 177.17 16.48 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.513 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -143.1 107.19 4.71 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.821 0.343 . . . . 0.0 111.046 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -96.37 118.16 32.34 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.691 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.4 ' OD2' ' CD ' ' A' ' 36' ' ' ARG . 0.2 OUTLIER -149.52 149.69 31.12 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.963 -179.944 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 39.8 t30 47.14 30.12 1.3 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.95 179.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 71.36 16.87 75.7 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.546 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.459 ' HB3' ' CZ ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -115.14 155.74 26.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.821 0.343 . . . . 0.0 110.823 -179.991 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 18.6 t-80 -111.38 83.97 1.86 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.151 -179.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.459 ' CZ ' ' HB3' ' A' ' 26' ' ' LYS . 0.9 OUTLIER -82.6 173.68 11.72 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.784 179.746 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.524 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 1.0 OUTLIER -109.74 140.92 43.07 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.596 179.709 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.66 HD12 ' H ' ' A' ' 30' ' ' ILE . 4.0 mp -36.47 151.62 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.207 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.452 ' HB2' ' O ' ' A' ' 30' ' ' ILE . 29.7 m-80 66.53 13.22 9.19 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.789 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.524 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 13.4 tt0 -100.46 149.16 23.96 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.844 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.46 ' HG2' ' OG1' ' A' ' 46' ' ' THR . 10.9 mt-30 -115.99 143.93 44.77 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.178 -179.715 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . 0.589 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 37.6 p90 -145.69 162.43 37.57 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.6 179.616 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -100.0 128.19 46.11 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.979 0.419 . . . . 0.0 111.439 -179.519 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.4 ' CD ' ' OD2' ' A' ' 23' ' ' ASP . 0.0 OUTLIER -132.2 -163.26 1.31 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.278 179.527 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.46 ' HA ' ' O ' ' A' ' 41' ' ' ASN . 1.2 t -147.46 134.73 20.6 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.822 0.344 . . . . 0.0 111.244 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.945 ' HB2' HD22 ' A' ' 43' ' ' LEU . 0.3 OUTLIER -90.02 89.67 7.8 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.486 179.71 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.499 ' CB ' ' O ' ' A' ' 38' ' ' TYR . 1.4 tp 82.89 -48.42 0.16 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.721 -179.729 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.436 ' O ' ' ND2' ' A' ' 41' ' ' ASN . . . 178.53 34.9 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.867 -0.683 . . . . 0.0 112.557 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.46 ' O ' ' HA ' ' A' ' 37' ' ' THR . 25.1 m120 -148.18 148.59 30.72 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.659 0.266 . . . . 0.0 110.934 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.434 ' C ' ' O ' ' A' ' 41' ' ' ASN . . . -36.53 141.96 0.1 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.695 179.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.945 HD22 ' HB2' ' A' ' 38' ' ' TYR . 21.9 tp -169.92 99.38 0.3 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.85 0.357 . . . . 0.0 111.27 -179.567 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.509 ' N ' ' O ' ' A' ' 57' ' ' GLU . 24.8 t -75.92 159.53 5.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.569 179.492 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.589 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 0.0 OUTLIER -140.77 144.91 35.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.856 0.36 . . . . 0.0 111.266 -179.769 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.46 ' OG1' ' HG2' ' A' ' 33' ' ' GLN . 86.1 m -129.66 123.48 31.31 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.915 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.477 ' SG ' ' HA ' ' A' ' 30' ' ' ILE . 30.3 t -80.63 137.61 36.36 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.002 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.437 ' CE1' ' O ' ' A' ' 46' ' ' THR . 5.5 m-85 -117.05 -2.27 11.75 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.975 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.561 ' N ' HG23 ' A' ' 30' ' ' ILE . . . 135.02 -173.62 21.51 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.438 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -85.13 -11.12 76.79 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.485 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -109.49 -44.32 3.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.819 0.342 . . . . 0.0 110.954 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 3.9 mtt180 -73.38 -29.39 62.59 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.049 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 75.26 -156.45 48.68 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.549 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.534 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 12.1 p90 -134.07 150.0 51.16 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.889 0.376 . . . . 0.0 110.952 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -120.46 104.39 9.95 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.839 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.478 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 1.2 m -67.48 163.78 20.27 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.936 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.632 ' C ' HD12 ' A' ' 43' ' ' LEU . 0.2 OUTLIER -166.6 142.34 4.53 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.862 179.889 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.48 ' N ' HD12 ' A' ' 43' ' ' LEU . 3.4 m -69.38 146.49 52.05 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.879 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.426 ' C ' ' O ' ' A' ' 58' ' ' SER . 0.9 OUTLIER -36.55 103.05 0.24 Allowed Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.871 179.947 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -49.82 145.2 18.81 Favored 'Trans proline' 0 N--CA 1.465 -0.169 0 C-N-CA 122.844 2.363 . . . . 0.0 112.482 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.44 ' O ' ' O ' ' A' ' 62' ' ' ALA . 44.9 tt0 -157.45 57.39 0.5 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.747 179.884 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.44 ' O ' ' O ' ' A' ' 61' ' ' GLU . . . 50.85 105.67 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.075 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.509 ' O ' ' CB ' ' A' ' 64' ' ' GLU . 3.0 tt0 -108.57 112.45 24.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.572 -179.859 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.664 ' O ' HG23 ' A' ' 65' ' ' THR . 3.6 mt-10 159.37 63.05 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.078 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.664 HG23 ' O ' ' A' ' 64' ' ' GLU . 0.1 OUTLIER 170.66 154.54 0.06 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.13 179.958 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 17.8 m -126.07 -154.55 0.63 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.835 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.406 ' O ' ' N ' ' A' ' 73' ' ' ASN . 44.6 t80 -158.3 -40.31 0.06 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.024 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . 0.515 ' O ' ' N ' ' A' ' 72' ' ' GLY . 3.7 t0 71.01 70.07 0.18 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.968 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -43.05 -29.41 0.35 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.915 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.584 ' CE2' ' HE3' ' A' ' 85' ' ' LYS . 7.5 m-30 -53.28 -54.18 40.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.947 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 25.4 m -119.97 -36.5 3.26 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.072 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . 0.515 ' N ' ' O ' ' A' ' 68' ' ' ASP . . . 97.79 47.71 2.06 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.439 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . 0.491 ' HB3' ' CZ ' ' A' ' 75' ' ' TYR . 0.4 OUTLIER -96.77 -172.56 2.5 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.787 0.327 . . . . 0.0 110.844 -179.979 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.491 ' O ' ' CD1' ' A' ' 75' ' ' TYR . 0.2 OUTLIER -120.78 117.99 28.87 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.016 179.913 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.491 ' CZ ' ' HB3' ' A' ' 73' ' ' ASN . 9.6 m-85 -136.87 144.75 43.72 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.906 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -83.53 165.19 19.31 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.961 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 13.5 p -81.11 -18.46 11.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.169 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -100.92 42.96 1.82 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.509 179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -164.21 133.1 3.7 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.813 0.34 . . . . 0.0 110.964 -179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 58.2 p -93.6 163.72 13.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.187 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 33.2 p90 -160.65 110.7 1.75 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.856 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -55.5 160.5 2.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.021 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.422 ' HA ' ' HD2' ' A' ' 84' ' ' PRO . 0.0 OUTLIER -148.91 96.59 3.75 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.8 179.888 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.422 ' HD2' ' HA ' ' A' ' 83' ' ' ARG . 36.8 Cg_endo -65.79 114.91 3.14 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.769 2.312 . . . . 0.0 112.333 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.584 ' HE3' ' CE2' ' A' ' 70' ' ' TYR . 0.5 OUTLIER -141.67 111.14 6.46 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.839 -179.978 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.454 ' CB ' ' O ' ' A' ' 85' ' ' LYS . 0.9 OUTLIER 80.65 -159.16 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.768 -179.963 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.445 ' O ' ' OG ' ' A' ' 87' ' ' SER . 2.3 t -89.85 17.32 6.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.919 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.581 ' HG2' ' CZ2' ' A' ' 90' ' ' TRP . 16.5 tpp -131.61 129.74 41.28 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.829 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -92.03 139.29 18.12 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.177 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . 0.581 ' CZ2' ' HG2' ' A' ' 88' ' ' MET . 1.7 m95 -136.4 152.21 50.37 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.823 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -104.89 87.65 2.71 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.842 179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 73.2 m -67.26 140.71 57.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.013 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.569 HG22 HG12 ' A' ' 95' ' ' ILE . 86.6 m -123.94 122.53 38.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.127 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.448 ' SG ' ' HB2' ' A' ' 75' ' ' TYR . 0.0 OUTLIER -63.08 69.65 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.798 -179.993 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.569 HG12 HG22 ' A' ' 93' ' ' THR . 1.2 mt -89.64 46.89 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.353 -179.845 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.454 ' HA2' ' HA2' ' A' ' 100' ' ' GLY . . . -52.4 -81.59 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.484 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.409 ' HA ' ' HG3' ' A' ' 63' ' ' GLU . . . 61.38 -89.05 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.811 0.338 . . . . 0.0 111.098 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -71.11 -30.59 67.39 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.488 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 9.1 ttt180 -174.87 -67.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.846 0.355 . . . . 0.0 110.923 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 0.454 ' HA2' ' HA2' ' A' ' 96' ' ' GLY . . . -167.84 91.05 0.1 OUTLIER Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.76 -0.733 . . . . 0.0 112.486 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 4.5 ttt85 -109.25 42.28 1.48 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.808 0.337 . . . . 0.0 110.971 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.403 ' HA ' ' O ' ' A' ' 93' ' ' THR . 1.2 mp -52.55 95.9 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.193 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 47.5 t -86.48 123.53 31.8 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.913 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 46.2 m -116.02 101.03 8.38 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.844 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 14.0 t -110.98 142.14 43.5 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.133 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.579 ' H ' HD12 ' A' ' 106' ' ' ILE . 4.6 mp -44.26 149.05 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.987 179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -49.09 139.9 10.05 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.881 0.372 . . . . 0.0 111.104 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -68.23 -33.28 74.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.897 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.228 -0.891 . . . . 0.0 110.938 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.447 ' OG ' ' HD2' ' A' ' 18' ' ' LYS . 3.8 p . . . . . 0 N--CA 1.485 1.321 0 CA-C-O 120.846 0.355 . . . . 0.0 111.252 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.447 ' HD2' ' OG ' ' A' ' 17' ' ' SER . 0.0 OUTLIER 55.21 89.76 0.1 OUTLIER Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.895 179.99 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.415 ' HB2' HD11 ' A' ' 30' ' ' ILE . 45.0 Cg_exo -56.24 -163.87 0.02 OUTLIER 'Trans proline' 0 C--O 1.231 0.137 0 C-N-CA 122.753 2.302 . . . . 0.0 112.262 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.37 162.82 3.28 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.665 -0.779 . . . . 0.0 112.474 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 25.0 m -127.4 106.85 9.48 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.87 0.367 . . . . 0.0 110.846 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 32.6 t80 -86.25 120.87 28.07 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.985 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.452 ' OD1' ' CB ' ' A' ' 26' ' ' LYS . 3.6 p-10 -97.42 -160.29 0.79 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.866 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.429 ' C ' ' O ' ' A' ' 23' ' ' ASP . 0.4 OUTLIER -34.96 -75.67 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.976 -0.557 . . . . 0.0 111.008 -179.983 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -133.64 33.78 2.51 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.845 -0.693 . . . . 0.0 112.632 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.517 ' HB3' ' CE2' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -140.16 141.17 36.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.836 0.351 . . . . 0.0 110.969 -179.997 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 10.4 t-160 -120.44 90.14 3.27 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.968 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.625 ' CE2' ' CB ' ' A' ' 34' ' ' TRP . 93.1 m-85 -87.26 161.64 17.88 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.094 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.532 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 3.6 tt0 -87.56 156.38 19.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.803 179.829 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.705 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.9 mp -44.45 147.73 0.31 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.399 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.437 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 24.0 m-80 65.03 13.43 8.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.162 179.704 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.532 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 1.0 OUTLIER -99.74 148.6 24.21 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.879 0.371 . . . . 0.0 110.781 179.851 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 25.6 mt-30 -115.96 151.0 36.25 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.913 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . 0.625 ' CB ' ' CE2' ' A' ' 28' ' ' TYR . 42.6 p90 -152.65 -174.45 4.92 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.902 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -114.61 132.45 56.35 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.019 -179.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.529 ' O ' ' CB ' ' A' ' 43' ' ' LEU . 3.1 ttt180 -139.22 165.92 25.9 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.725 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.401 ' OG1' ' C ' ' A' ' 41' ' ' ASN . 2.2 t -136.92 135.9 38.15 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.917 -179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.797 ' CE1' HD13 ' A' ' 39' ' ' LEU . 1.1 t80 -118.37 125.32 49.76 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.773 179.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.797 HD13 ' CE1' ' A' ' 38' ' ' TYR . 0.8 OUTLIER 65.36 14.42 9.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.605 -179.737 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 87.45 44.61 5.51 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.58 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.427 ' O ' ' C ' ' A' ' 42' ' ' ALA . 27.2 m-80 -144.09 125.5 14.8 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.751 0.31 . . . . 0.0 110.89 179.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.459 ' O ' ' CD1' ' A' ' 43' ' ' LEU . . . -35.04 147.57 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.945 -179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.529 ' CB ' ' O ' ' A' ' 36' ' ' ARG . 1.5 tp -165.49 157.78 15.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.988 0.423 . . . . 0.0 111.297 -179.686 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.479 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 3.6 t -126.2 135.46 63.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.335 179.382 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.593 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 0.5 OUTLIER -118.79 162.45 18.45 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.428 -179.486 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 20.5 m -147.69 131.14 16.68 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.895 179.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.501 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 14.3 t -91.35 132.26 36.3 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.882 0.372 . . . . 0.0 111.052 -179.85 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.499 ' HB2' ' HB3' ' A' ' 52' ' ' ARG . 2.0 m-85 -105.17 -35.96 7.42 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.783 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.515 ' HA3' ' CG2' ' A' ' 30' ' ' ILE . . . 76.63 173.08 36.63 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.489 -179.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . 0.52 ' O ' ' CB ' ' A' ' 51' ' ' SER . . . 66.91 18.0 68.15 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.64 -0.79 . . . . 0.0 112.532 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.52 ' CB ' ' O ' ' A' ' 50' ' ' GLY . 1.0 OUTLIER 85.78 -0.56 0.73 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.671 0.272 . . . . 0.0 111.208 179.964 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.499 ' HB3' ' HB2' ' A' ' 48' ' ' TYR . 0.0 OUTLIER -56.87 -27.91 61.07 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.937 0.399 . . . . 0.0 110.882 179.942 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 74.45 129.5 0.19 Allowed Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.67 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.559 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 10.3 p90 -63.97 177.63 0.75 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.843 0.354 . . . . 0.0 110.825 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.515 ' ND2' ' O ' ' A' ' 54' ' ' PHE . 29.4 m120 -152.01 123.92 8.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.929 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.479 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.8 OUTLIER -104.56 155.88 18.45 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.908 179.951 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -170.5 171.75 6.31 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.019 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.432 ' HA ' HD12 ' A' ' 43' ' ' LEU . 0.1 OUTLIER -57.28 136.44 56.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.932 -179.975 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.456 ' O ' ' O ' ' A' ' 60' ' ' PRO . 2.3 tppp? -39.55 136.7 1.12 Allowed Pre-proline 0 C--N 1.329 -0.316 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.054 179.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.456 ' O ' ' O ' ' A' ' 59' ' ' LYS . 76.4 Cg_exo -49.23 -169.1 0.0 OUTLIER 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.858 2.372 . . . . 0.0 112.36 179.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -74.58 -59.09 2.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.973 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -150.73 130.33 13.08 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.113 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -95.45 -31.79 13.2 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.499 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.508 ' HG3' ' CG2' ' A' ' 77' ' ' VAL . 23.2 tt0 -95.85 57.03 1.78 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.904 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.46 HG23 ' O ' ' A' ' 64' ' ' GLU . 22.4 p -157.06 -174.97 5.17 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.194 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -144.7 -165.19 2.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.844 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 86.9 t80 -163.83 97.94 0.86 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.819 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . 0.486 ' O ' ' N ' ' A' ' 72' ' ' GLY . 3.9 m-20 -72.26 83.57 1.04 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.962 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -39.41 -30.25 0.06 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.882 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 39.0 m-85 -57.45 -61.69 2.31 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.948 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 24.9 p -112.09 19.51 17.74 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.105 179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . 0.486 ' N ' ' O ' ' A' ' 68' ' ' ASP . . . 38.69 54.96 2.24 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.547 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -124.22 160.19 28.46 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.835 0.35 . . . . 0.0 110.702 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.52 155.81 17.64 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.19 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 25.5 m-85 -139.09 -172.09 3.25 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.836 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -104.83 155.75 18.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.939 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.528 HG13 ' O ' ' A' ' 94' ' ' CYS . 2.5 t -90.63 25.73 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.071 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -138.44 17.85 3.29 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.62 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -142.04 136.71 30.49 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.819 0.342 . . . . 0.0 110.974 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.455 HG22 HG23 ' A' ' 93' ' ' THR . 1.4 p -93.67 114.08 26.3 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.116 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.571 ' OH ' HD13 ' A' ' 102' ' ' ILE . 42.5 p90 -102.93 136.47 42.7 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.883 -179.935 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 90.1 mt-10 -97.37 164.73 12.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.72 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -157.79 117.68 1.93 Allowed Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.912 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -70.86 103.42 1.34 Allowed 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.671 2.247 . . . . 0.0 112.299 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -134.28 161.65 34.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.986 -179.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 51.4 31.08 6.78 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.932 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 71.34 5.36 5.41 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.087 179.934 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -132.62 178.57 6.74 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.924 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.503 ' C ' ' CD1' ' A' ' 90' ' ' TRP . 1.1 mt -116.67 145.33 22.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.076 179.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . 0.631 ' CZ3' ' CD1' ' A' ' 106' ' ' ILE . 0.0 OUTLIER -144.65 128.56 17.43 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.908 179.972 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.473 ' N ' ' OD1' ' A' ' 91' ' ' ASP . 3.9 p30 -66.88 95.07 0.35 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.744 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . 0.505 ' O ' ' CD1' ' A' ' 81' ' ' TYR . 64.5 m -79.21 96.17 5.83 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.805 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.455 HG23 HG22 ' A' ' 80' ' ' THR . 2.6 m -74.83 148.45 40.25 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.017 179.934 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.797 ' HA ' HG22 ' A' ' 102' ' ' ILE . 0.1 OUTLIER -96.8 51.01 1.13 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.916 -179.923 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 1.8 mt -44.85 -40.56 2.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.104 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.668 ' O ' ' HB3' ' A' ' 97' ' ' ALA . . . 44.37 -163.08 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.502 179.925 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.668 ' HB3' ' O ' ' A' ' 96' ' ' GLY . . . 83.7 94.84 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.798 0.332 . . . . 0.0 111.075 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 117.67 -62.3 0.42 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.493 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.67 34.59 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.797 0.332 . . . . 0.0 110.88 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 0.449 ' HA2' ' HA2' ' A' ' 96' ' ' GLY . . . 55.16 79.68 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.786 -0.721 . . . . 0.0 112.556 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.518 ' O ' ' CG ' ' A' ' 101' ' ' ARG . 1.4 tmt_? -106.9 56.77 0.64 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.843 0.354 . . . . 0.0 110.862 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.797 HG22 ' HA ' ' A' ' 94' ' ' CYS . 0.8 OUTLIER -50.3 139.74 4.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.288 -179.922 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 12.1 t -115.84 129.69 56.53 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.745 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.471 ' HB3' ' HB2' ' A' ' 90' ' ' TRP . 8.9 m -118.58 143.38 46.82 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.002 -179.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . 0.474 ' O ' ' HA ' ' A' ' 90' ' ' TRP . 0.3 OUTLIER -151.65 153.77 35.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.039 179.913 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.631 ' CD1' ' CZ3' ' A' ' 90' ' ' TRP . 2.8 mp -59.71 156.6 2.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.311 -179.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.477 ' N ' HG22 ' A' ' 106' ' ' ILE . . . 46.51 -178.57 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.292 179.856 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -97.58 40.78 1.14 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.847 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.102 0 CA-C-O 118.299 -0.858 . . . . 0.0 110.91 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.442 ' O ' ' O ' ' A' ' 18' ' ' LYS . 4.4 m . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 120.762 0.315 . . . . 0.0 111.062 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.442 ' O ' ' O ' ' A' ' 17' ' ' SER . 4.5 mmtp 58.32 145.76 0.05 OUTLIER Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.759 179.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.702 ' HB2' HD11 ' A' ' 30' ' ' ILE . 41.6 Cg_endo -67.15 119.63 6.67 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.655 2.237 . . . . 0.0 112.348 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 154.5 -163.13 31.04 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.684 -0.769 . . . . 0.0 112.536 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 80.4 m -139.39 72.65 1.41 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.818 0.342 . . . . 0.0 110.893 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 30.8 t80 -52.5 117.96 3.25 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.815 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 41.6 t0 -164.86 150.26 9.77 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.885 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.435 ' CG ' ' O ' ' A' ' 24' ' ' ASN . 28.1 t-20 62.25 26.66 15.98 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.904 179.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 72.2 11.31 75.23 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.592 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.585 ' HB3' ' CE1' ' A' ' 28' ' ' TYR . 0.4 OUTLIER -122.12 151.59 40.77 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.814 0.34 . . . . 0.0 110.863 -179.923 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 5.1 t-160 -111.92 89.98 3.21 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.085 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.585 ' CE1' ' HB3' ' A' ' 26' ' ' LYS . 3.5 m-85 -79.62 171.02 15.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.028 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.529 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 0.9 OUTLIER -111.92 139.26 47.56 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.82 179.915 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.702 HD11 ' HB2' ' A' ' 19' ' ' PRO . 3.9 mp -35.0 140.38 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.534 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 13.5 m-20 72.62 8.75 5.65 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.15 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.529 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 56.1 tt0 -97.82 155.24 17.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.849 0.357 . . . . 0.0 111.057 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.623 ' CG ' HG23 ' A' ' 46' ' ' THR . 28.5 mt-30 -118.05 156.99 27.64 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.867 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . 0.588 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 38.2 p90 -155.35 166.95 31.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.707 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -99.77 123.13 43.72 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.169 -179.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.62 -163.91 0.92 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.609 179.754 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.585 HG23 ' O ' ' A' ' 37' ' ' THR . 3.4 t -167.08 32.37 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.353 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.732 ' HB2' HD22 ' A' ' 43' ' ' LEU . 0.2 OUTLIER -40.33 143.87 0.27 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.847 179.905 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.463 ' HB2' ' O ' ' A' ' 38' ' ' TYR . 2.3 mm? 66.5 16.5 10.43 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.857 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 66.95 42.07 92.94 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.524 179.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.464 ' O ' ' HA ' ' A' ' 37' ' ' THR . 51.6 m-80 -152.23 132.11 13.32 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.596 0.236 . . . . 0.0 110.781 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.772 ' O ' HD12 ' A' ' 43' ' ' LEU . . . -31.01 135.1 0.06 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.458 -179.761 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.93 HD23 ' HB3' ' A' ' 56' ' ' CYS . 0.7 OUTLIER -153.86 174.66 14.3 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.167 -0.469 . . . . 0.0 111.13 -179.732 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.503 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.6 t -144.88 127.05 9.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.478 179.541 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.588 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 0.8 OUTLIER -117.72 163.41 16.52 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.383 -179.528 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.623 HG23 ' CG ' ' A' ' 33' ' ' GLN . 2.0 m -145.13 134.81 23.42 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.926 179.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.57 ' N ' ' CH2' ' A' ' 34' ' ' TRP . 14.0 t -82.58 135.13 35.15 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.928 -179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.47 ' C ' HG23 ' A' ' 30' ' ' ILE . 2.2 m-85 -110.62 -32.35 6.92 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.881 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 92.03 -166.95 30.16 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.519 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 42.0 -114.73 0.73 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.751 -0.737 . . . . 0.0 112.631 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -126.07 1.63 7.22 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.659 0.266 . . . . 0.0 111.208 -179.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.508 ' NE ' ' HA ' ' A' ' 52' ' ' ARG . 0.1 OUTLIER -59.25 -38.39 79.95 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.785 0.326 . . . . 0.0 110.98 -179.923 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 70.59 141.34 0.19 Allowed Glycine 0 N--CA 1.45 -0.389 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.631 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.574 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 7.7 p90 -59.7 172.97 0.62 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.848 0.356 . . . . 0.0 110.807 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -156.06 108.35 2.59 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.762 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.93 ' HB3' HD23 ' A' ' 43' ' ' LEU . 2.1 m -75.5 172.18 12.98 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.032 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -141.28 -94.06 0.14 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.125 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.9 t 178.86 131.33 0.08 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.874 0.369 . . . . 0.0 110.917 -179.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.595 ' CB ' ' HB1' ' A' ' 42' ' ' ALA . 0.2 OUTLIER -82.0 114.27 49.4 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.792 179.905 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_exo -42.76 111.42 0.21 Allowed 'Trans proline' 0 N--CA 1.462 -0.336 0 C-N-CA 122.709 2.273 . . . . 0.0 112.369 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -117.54 22.42 12.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.919 -179.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -161.5 -165.02 1.21 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.124 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -99.71 -29.23 12.77 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.57 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 72.77 -172.65 0.14 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.947 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.447 ' HA ' ' O ' ' A' ' 75' ' ' TYR . 24.4 p 48.83 -167.03 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.02 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.625 ' O ' HG23 ' A' ' 74' ' ' THR . 5.7 p 167.23 177.8 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.962 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 38.3 t80 -129.36 111.53 12.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.906 179.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -79.38 94.13 5.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.926 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.434 ' HB3' ' CE1' ' A' ' 70' ' ' TYR . 0.1 OUTLIER -51.87 173.91 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.749 179.925 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.481 ' CD1' ' N ' ' A' ' 70' ' ' TYR . 0.8 OUTLIER 76.19 -54.58 0.6 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.815 -179.961 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -107.22 -17.57 14.12 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.108 179.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 54.07 72.72 0.5 Allowed Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.48 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -140.83 96.27 2.99 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.789 0.328 . . . . 0.0 110.838 -179.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.625 HG23 ' O ' ' A' ' 66' ' ' CYS . 85.0 m -50.74 135.99 22.69 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.033 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.447 ' O ' ' HA ' ' A' ' 65' ' ' THR . 21.9 m-85 -129.47 175.3 8.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.893 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.09 133.84 41.22 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.826 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.402 ' HA ' ' O ' ' A' ' 94' ' ' CYS . 7.1 p -46.4 -39.77 3.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.029 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -94.99 33.14 5.57 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.472 -179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -135.13 114.67 12.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.882 0.373 . . . . 0.0 110.955 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.608 HG22 HG23 ' A' ' 93' ' ' THR . 44.9 p -86.36 150.31 24.42 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.163 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.524 ' CE1' ' HB3' ' A' ' 92' ' ' CYS . 32.9 p90 -139.4 -178.6 5.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.808 179.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.412 ' OE2' ' OD1' ' A' ' 108' ' ' ASN . 1.9 mp0 -115.97 151.38 35.54 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.888 179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 14.7 ttm180 -139.31 101.03 7.59 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.96 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -75.34 113.71 3.83 Favored 'Trans proline' 0 N--CA 1.464 -0.264 0 C-N-CA 122.798 2.332 . . . . 0.0 112.364 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.7 mtpp -157.34 161.95 39.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.924 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 50.06 25.5 1.73 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.871 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.2 t 72.98 8.11 5.43 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.041 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.447 ' O ' ' NE1' ' A' ' 90' ' ' TRP . 0.0 OUTLIER -138.57 134.02 33.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.955 179.991 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.54 ' C ' ' CD1' ' A' ' 90' ' ' TRP . 2.8 mp -85.3 157.97 3.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.058 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . 0.55 ' CH2' HD11 ' A' ' 106' ' ' ILE . 4.5 m95 -148.89 107.95 3.89 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.95 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.507 ' N ' ' O ' ' A' ' 105' ' ' THR . 11.1 t70 -58.58 91.68 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.785 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . 0.524 ' HB3' ' CE1' ' A' ' 81' ' ' TYR . 0.8 OUTLIER -74.46 150.49 39.89 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.134 -179.939 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.608 HG23 HG22 ' A' ' 80' ' ' THR . 41.7 m -127.49 108.1 10.52 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.993 179.875 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.402 ' O ' ' HA ' ' A' ' 77' ' ' VAL . 20.3 t -53.85 82.35 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.948 -179.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.52 ' N ' ' O ' ' A' ' 93' ' ' THR . 1.5 mt -77.89 -26.57 14.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.216 -179.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.45 ' HA3' ' HA3' ' A' ' 100' ' ' GLY . . . -158.42 164.03 33.26 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.514 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.457 ' O ' ' N ' ' A' ' 99' ' ' ARG . . . -91.92 104.14 16.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.781 0.324 . . . . 0.0 111.098 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 36.95 30.7 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.479 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.457 ' N ' ' O ' ' A' ' 97' ' ' ALA . 0.4 OUTLIER -147.98 -46.14 0.16 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.783 0.325 . . . . 0.0 110.935 -179.962 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 0.48 ' C ' ' CG ' ' A' ' 101' ' ' ARG . . . -65.08 -98.07 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.572 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.48 ' CG ' ' C ' ' A' ' 100' ' ' GLY . 0.0 OUTLIER 172.02 94.3 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.751 0.31 . . . . 0.0 110.95 -179.987 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 43.0 mt -72.07 78.15 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.125 179.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.461 ' O ' ' HA ' ' A' ' 92' ' ' CYS . 1.4 t -54.93 151.06 9.23 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.078 -179.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.485 ' SG ' ' HB2' ' A' ' 90' ' ' TRP . 0.0 OUTLIER -130.31 150.99 51.29 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.75 179.924 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . 0.507 ' O ' ' N ' ' A' ' 91' ' ' ASP . 0.2 OUTLIER -167.28 134.2 2.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.916 0.389 . . . . 0.0 111.356 -179.947 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.55 HD11 ' CH2' ' A' ' 90' ' ' TRP . 1.2 mp -66.57 165.25 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.118 179.863 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.509 ' N ' HG22 ' A' ' 106' ' ' ILE . . . 68.61 120.08 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.142 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . 0.412 ' OD1' ' OE2' ' A' ' 82' ' ' GLU . 0.1 OUTLIER -88.73 76.45 8.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.943 -179.979 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 20.0 ttt85 . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.293 -0.861 . . . . 0.0 110.879 179.883 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.486 1.343 0 CA-C-O 120.784 0.326 . . . . 0.0 111.237 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.6 mptt -41.94 146.24 0.64 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.895 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_exo -46.24 110.85 0.3 Allowed 'Trans proline' 0 N--CA 1.465 -0.191 0 C-N-CA 122.713 2.276 . . . . 0.0 112.419 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 137.02 163.29 9.68 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.464 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 35.3 m -112.14 135.19 53.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.826 0.346 . . . . 0.0 110.914 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -115.09 115.68 27.18 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.85 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -160.21 159.92 32.14 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.853 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.512 ' ND2' ' O ' ' A' ' 24' ' ' ASN . 12.4 t30 58.8 25.19 13.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.9 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 72.89 7.27 69.83 Favored Glycine 0 N--CA 1.452 -0.3 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.443 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.496 ' HB3' ' CZ ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -122.91 142.3 50.95 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.756 0.312 . . . . 0.0 111.004 179.963 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 2.9 t-160 -114.49 88.28 2.82 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.862 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.496 ' CZ ' ' HB3' ' A' ' 26' ' ' LYS . 0.5 OUTLIER -79.63 -170.28 2.3 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.939 -179.939 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.493 ' O ' ' HB2' ' A' ' 32' ' ' GLN . 0.0 OUTLIER -102.12 173.24 6.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.953 -179.962 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.713 HD12 ' H ' ' A' ' 30' ' ' ILE . 2.9 mp -66.4 155.63 7.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.469 -179.777 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 85.7 m-20 53.78 18.02 1.44 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.202 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.493 ' HB2' ' O ' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -95.29 151.46 19.23 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.668 179.823 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 -115.8 144.77 43.53 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.101 -179.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . 0.549 ' CZ3' ' HB2' ' A' ' 47' ' ' CYS . 41.2 p90 -148.9 178.78 8.38 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.753 179.663 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -103.11 129.87 50.1 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.025 0.441 . . . . 0.0 111.28 -179.715 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.528 ' O ' ' N ' ' A' ' 43' ' ' LEU . 32.5 ttt-85 -132.99 170.66 15.04 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.914 -0.584 . . . . 0.0 110.296 179.558 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.485 ' HA ' ' HB2' ' A' ' 43' ' ' LEU . 1.2 t -139.46 132.78 29.99 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.872 0.368 . . . . 0.0 111.477 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.512 ' CB ' HD22 ' A' ' 43' ' ' LEU . 45.9 t80 -124.05 124.21 42.04 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.655 179.793 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 70.33 22.37 5.39 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.989 0.424 . . . . 0.0 110.478 -179.711 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 76.4 41.06 26.53 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.923 -0.656 . . . . 0.0 112.501 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.441 ' C ' ' HG1' ' A' ' 37' ' ' THR . 69.0 m-80 -145.46 138.08 25.92 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.819 0.342 . . . . 0.0 111.254 179.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -37.75 152.31 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.13 -0.487 . . . . 0.0 110.876 179.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.528 ' N ' ' O ' ' A' ' 36' ' ' ARG . 2.2 tp -167.28 159.62 12.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.22 -179.839 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.503 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.6 t -130.24 129.11 64.99 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.661 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.567 ' SG ' ' CD1' ' A' ' 54' ' ' PHE . 0.8 OUTLIER -110.75 163.53 13.68 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.32 -179.715 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 35.4 m -144.78 118.41 9.17 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.031 179.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.549 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 35.2 t -72.71 145.62 47.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.018 -179.856 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.517 ' CB ' ' HB3' ' A' ' 52' ' ' ARG . 4.9 m-85 -119.39 -16.3 8.98 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.921 179.939 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.538 ' N ' HG23 ' A' ' 30' ' ' ILE . . . 92.57 179.95 40.5 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.505 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . 0.417 ' C ' ' O ' ' A' ' 49' ' ' GLY . . . 36.13 -107.8 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.482 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 28.4 t -131.67 7.79 4.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.776 0.322 . . . . 0.0 111.05 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.517 ' HB3' ' CB ' ' A' ' 48' ' ' TYR . 7.3 mmt180 -52.66 -19.77 2.61 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.966 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 68.62 151.59 0.38 Allowed Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.355 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.567 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 4.3 p90 -92.96 157.95 16.06 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.834 0.35 . . . . 0.0 110.945 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -116.87 115.6 25.83 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.623 179.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.503 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.1 OUTLIER -102.93 152.81 20.87 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.363 -0.38 . . . . 0.0 111.203 -179.778 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -175.26 179.49 1.51 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.814 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 26.7 t -73.9 135.14 43.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.925 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.462 ' CD ' HG21 ' A' ' 44' ' ' VAL . 3.9 tptp -39.88 111.55 0.73 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.931 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -69.61 156.3 64.13 Favored 'Trans proline' 0 C--O 1.232 0.195 0 C-N-CA 122.665 2.243 . . . . 0.0 112.293 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -81.38 -50.14 9.84 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.906 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -156.93 148.21 22.12 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.062 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -103.7 -38.93 6.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.468 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.01 -176.38 2.07 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.91 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 1.5 p 64.85 -162.27 0.27 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.198 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.469 ' O ' ' HA ' ' A' ' 74' ' ' THR . 29.0 m -160.19 157.6 28.58 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.857 -179.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.429 ' O ' ' C ' ' A' ' 68' ' ' ASP . 71.2 t80 -110.14 -17.65 13.5 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.075 -0.512 . . . . 0.0 110.67 179.776 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . 0.443 ' OD2' ' CE2' ' A' ' 81' ' ' TYR . 4.3 t0 35.52 93.56 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.027 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.577 ' O ' ' CD2' ' A' ' 70' ' ' TYR . 4.0 ptmt -52.87 -170.13 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.624 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.577 ' CD2' ' O ' ' A' ' 69' ' ' LYS . 8.1 m-85 83.87 -56.4 0.14 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.837 0.351 . . . . 0.0 110.922 -179.829 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -134.45 17.55 3.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.159 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 45.14 58.68 4.92 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.776 -0.726 . . . . 0.0 112.391 -179.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -89.61 164.86 14.57 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.811 0.339 . . . . 0.0 110.894 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.469 ' HA ' ' O ' ' A' ' 66' ' ' CYS . 0.9 OUTLIER -118.29 90.19 3.28 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.134 179.905 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 16.6 m-30 -97.94 -168.85 1.73 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.861 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.94 162.49 30.54 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.224 -0.443 . . . . 0.0 110.763 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 3.4 t -76.58 -22.92 15.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.134 179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -92.18 15.04 63.01 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.566 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -151.53 113.73 4.54 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.771 0.319 . . . . 0.0 110.815 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.812 ' HB ' HG23 ' A' ' 93' ' ' THR . 1.3 t -74.18 179.43 4.47 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.12 179.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.734 ' OH ' HG21 ' A' ' 102' ' ' ILE . 45.7 p90 -153.71 168.26 26.84 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.931 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -110.64 144.21 39.89 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.706 179.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -147.04 96.02 4.35 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.0 -179.888 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_exo -56.22 138.88 84.8 Favored 'Trans proline' 0 N--CA 1.466 -0.134 0 C-N-CA 122.836 2.357 . . . . 0.0 112.044 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.428 ' O ' ' N ' ' A' ' 87' ' ' SER . 0.2 OUTLIER -155.39 165.11 37.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.917 0.389 . . . . 0.0 111.095 -179.932 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 46.76 -92.7 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.024 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.428 ' N ' ' O ' ' A' ' 85' ' ' LYS . 0.8 OUTLIER -152.16 18.37 0.66 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.969 -179.964 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.408 ' CE ' ' HA ' ' A' ' 88' ' ' MET . 0.6 OUTLIER -147.1 167.45 24.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.878 -179.995 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.411 ' O ' ' N ' ' A' ' 107' ' ' ALA . 4.0 mt -107.39 140.34 26.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.063 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . 0.533 ' CD1' ' N ' ' A' ' 90' ' ' TRP . 0.7 OUTLIER -131.86 124.5 29.67 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.953 -179.868 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -67.1 72.08 0.1 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.742 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . 0.48 ' HA ' ' O ' ' A' ' 103' ' ' SER . 54.3 m -59.89 111.83 1.62 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.024 -179.845 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.812 HG23 ' HB ' ' A' ' 80' ' ' THR . 32.2 m -103.79 119.74 39.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.98 179.803 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.818 ' HA ' HD12 ' A' ' 102' ' ' ILE . 0.0 OUTLIER -58.53 80.53 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.832 -179.907 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.467 ' N ' ' O ' ' A' ' 93' ' ' THR . 2.1 mt -98.87 101.05 11.61 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.312 -179.84 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 144.66 176.19 18.45 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.5 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -69.23 58.82 0.11 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.837 0.351 . . . . 0.0 111.087 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 88.43 -23.47 15.53 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.559 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -176.58 55.81 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.846 0.355 . . . . 0.0 110.961 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -89.75 -37.16 6.99 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.39 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.517 ' O ' ' N ' ' A' ' 103' ' ' SER . 2.3 ptp85 -178.58 49.33 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.842 0.353 . . . . 0.0 110.74 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.818 HD12 ' HA ' ' A' ' 94' ' ' CYS . 10.4 mm -38.39 90.48 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.262 -179.903 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.517 ' N ' ' O ' ' A' ' 101' ' ' ARG . 21.9 t -69.08 174.2 4.8 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.603 179.777 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.451 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 20.1 m -155.76 124.35 5.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.032 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 2.9 p -92.89 104.67 16.89 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.108 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.507 HG13 ' CZ3' ' A' ' 90' ' ' TRP . 1.3 tt -43.99 151.0 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.083 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.411 ' N ' ' O ' ' A' ' 89' ' ' ILE . . . -121.91 126.25 48.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.063 -179.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 22.1 p30 -147.49 173.14 12.95 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.888 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.284 -0.865 . . . . 0.0 110.866 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 46.3 p . . . . . 0 N--CA 1.487 1.394 0 CA-C-O 120.81 0.338 . . . . 0.0 111.136 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.407 ' O ' ' O ' ' A' ' 19' ' ' PRO . 3.0 mtmt -115.03 90.93 24.94 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.899 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.407 ' O ' ' O ' ' A' ' 18' ' ' LYS . 69.2 Cg_exo -50.84 -169.08 0.0 OUTLIER 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.739 2.293 . . . . 0.0 112.303 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 69.18 -167.82 45.91 Favored Glycine 0 N--CA 1.45 -0.378 0 C-N-CA 120.801 -0.714 . . . . 0.0 112.454 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 54.5 m -126.79 132.42 51.04 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.842 0.353 . . . . 0.0 110.938 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 11.9 t80 -105.98 123.17 47.56 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.772 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -156.99 134.25 10.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.057 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.465 ' OD1' ' O ' ' A' ' 24' ' ' ASN . 29.8 t30 63.33 11.09 5.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.132 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 97.49 -13.19 64.5 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.8 179.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.77 146.44 24.48 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.784 0.326 . . . . 0.0 110.708 179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 9.9 t-160 -118.21 90.89 3.43 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.264 -179.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 2.0 m-85 -80.91 -165.82 0.99 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.822 179.77 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.52 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 0.5 OUTLIER -116.59 158.71 23.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.729 179.799 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.681 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.2 mp -51.98 152.54 0.79 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.303 -179.791 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.529 ' ND2' HG22 ' A' ' 30' ' ' ILE . 1.6 m-80 55.07 20.49 3.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.162 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.52 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 18.7 tt0 -101.28 152.08 21.12 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.759 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.421 ' HG2' ' OG1' ' A' ' 46' ' ' THR . 19.9 mt-30 -117.22 145.11 44.11 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.021 -179.836 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . 0.603 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 38.2 p90 -146.89 177.56 9.03 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.736 179.771 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -107.78 133.33 52.32 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.285 -179.631 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.436 ' NE ' ' O ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -132.78 -168.83 2.13 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.449 179.569 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.582 ' HG1' ' C ' ' A' ' 41' ' ' ASN . 1.1 t -158.48 145.4 17.57 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.886 0.374 . . . . 0.0 111.283 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.538 ' CE1' HD13 ' A' ' 39' ' ' LEU . 41.0 t80 -132.77 132.28 42.08 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.655 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.538 HD13 ' CE1' ' A' ' 38' ' ' TYR . 0.5 OUTLIER 57.4 22.36 7.82 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.563 -179.727 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 81.88 42.69 8.74 Favored Glycine 0 N--CA 1.448 -0.544 0 C-N-CA 120.859 -0.686 . . . . 0.0 112.558 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.582 ' C ' ' HG1' ' A' ' 37' ' ' THR . 83.9 m-20 -143.6 130.95 20.92 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 120.802 0.334 . . . . 0.0 111.137 179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.522 ' O ' ' CD1' ' A' ' 43' ' ' LEU . . . -39.34 156.64 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.838 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.522 ' CD1' ' O ' ' A' ' 42' ' ' ALA . 1.4 tp -169.32 160.07 9.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.217 -179.905 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.496 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.9 t -127.29 128.77 70.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.625 179.624 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.603 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 0.8 OUTLIER -114.69 151.39 33.71 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.148 -179.719 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.421 ' OG1' ' HG2' ' A' ' 33' ' ' GLN . 29.3 m -135.61 133.75 38.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.054 179.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.524 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 28.4 t -85.7 160.86 19.44 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.813 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.514 ' CB ' ' HB3' ' A' ' 52' ' ' ARG . 75.1 m-85 -133.36 -39.65 0.91 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.943 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.475 ' O ' ' N ' ' A' ' 51' ' ' SER . . . 154.74 45.52 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.385 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.5 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 64.52 -69.32 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.44 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.475 ' N ' ' O ' ' A' ' 49' ' ' GLY . 12.2 m -63.86 -48.06 78.25 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.805 0.336 . . . . 0.0 110.847 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.514 ' HB3' ' CB ' ' A' ' 48' ' ' TYR . 0.2 OUTLIER -56.63 -23.36 40.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.865 179.9 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . 0.495 ' O ' ' CD1' ' A' ' 48' ' ' TYR . . . 68.98 145.43 0.16 Allowed Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.715 -0.755 . . . . 0.0 112.594 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.569 ' CE1' ' SG ' ' A' ' 45' ' ' CYS . 13.1 p90 -86.73 170.05 12.1 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.872 0.368 . . . . 0.0 110.798 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.431 ' O ' ' HA ' ' A' ' 45' ' ' CYS . 5.0 m120 -141.0 138.28 33.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.728 179.857 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.496 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.5 OUTLIER -117.83 159.97 22.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.105 -179.846 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.454 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 1.6 pm0 -168.42 172.14 8.55 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.865 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.514 ' HA ' HD12 ' A' ' 43' ' ' LEU . 0.9 OUTLIER -76.5 152.27 36.14 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.872 -179.999 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -45.33 116.51 3.07 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.953 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -50.66 -23.31 10.9 Favored 'Trans proline' 0 C--O 1.231 0.159 0 C-N-CA 122.719 2.279 . . . . 0.0 112.344 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.459 ' O ' ' O ' ' A' ' 62' ' ' ALA . 0.7 OUTLIER -70.7 58.0 0.2 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.939 -179.993 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.459 ' O ' ' O ' ' A' ' 61' ' ' GLU . . . 42.21 -168.96 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.014 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -74.25 -27.37 60.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.483 179.751 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.504 ' CB ' HG12 ' A' ' 77' ' ' VAL . 1.6 mp0 -81.24 156.68 25.49 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.789 179.831 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.459 ' OG1' ' N ' ' A' ' 66' ' ' CYS . 2.6 t 175.37 177.97 0.17 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.996 0.427 . . . . 0.0 111.378 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.459 ' N ' ' OG1' ' A' ' 65' ' ' THR . 0.1 OUTLIER 175.11 -162.34 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.727 -179.989 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.479 ' HA ' ' O ' ' A' ' 73' ' ' ASN . 68.9 t80 -170.07 -38.73 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.339 -0.391 . . . . 0.0 111.045 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 4.6 t70 49.98 88.11 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.757 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.453 ' C ' ' CG ' ' A' ' 70' ' ' TYR . 1.8 mtmt -59.31 159.5 7.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.89 -179.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.453 ' CG ' ' C ' ' A' ' 69' ' ' LYS . 1.0 OUTLIER 77.68 17.35 1.4 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.008 179.981 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 2.9 m -162.86 -44.93 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.234 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 77.0 75.33 0.92 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.581 -0.818 . . . . 0.0 112.49 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . 0.479 ' O ' ' HA ' ' A' ' 67' ' ' PHE . 3.0 m120 -129.42 -172.29 2.71 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.88 0.371 . . . . 0.0 110.808 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 1.3 m -146.8 100.85 3.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.022 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.41 ' N ' ' CD1' ' A' ' 75' ' ' TYR . 3.6 m-30 -92.85 -160.54 0.76 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.81 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.456 ' O ' ' C ' ' A' ' 77' ' ' VAL . 0.4 OUTLIER -142.85 60.51 1.42 Allowed 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.785 179.825 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.783 ' O ' HG22 ' A' ' 77' ' ' VAL . 6.6 p 29.32 44.71 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.182 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.62 179.807 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -160.41 41.55 0.44 Allowed Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.508 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -160.75 109.06 1.6 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.775 0.321 . . . . 0.0 110.861 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 1.1 t -96.15 172.44 7.98 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.113 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 42.2 p90 -165.54 -174.04 2.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.829 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 -114.77 126.07 54.42 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.832 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 5.0 ttm180 -130.77 90.99 38.45 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.129 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -57.33 120.46 8.39 Favored 'Trans proline' 0 C--O 1.232 0.187 0 C-N-CA 122.744 2.296 . . . . 0.0 112.061 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.6 tptp -126.08 146.26 50.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.013 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 60.74 -84.66 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.934 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.1 p -155.81 21.47 0.39 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.017 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 1.8 ttt -144.55 164.71 30.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.881 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.495 ' C ' ' CD1' ' A' ' 90' ' ' TRP . 2.2 mt -99.42 150.99 4.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.139 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . 0.584 ' CE3' ' HA ' ' A' ' 106' ' ' ILE . 4.5 m95 -147.08 120.72 9.15 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.867 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -70.82 58.49 0.21 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.985 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . 0.418 ' HA ' ' HA ' ' A' ' 104' ' ' CYS . 84.5 m -45.4 136.24 5.61 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.871 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 40.9 m -122.72 139.25 54.17 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.146 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.42 ' O ' ' HA ' ' A' ' 77' ' ' VAL . 30.8 t -69.95 68.2 0.29 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.848 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.735 HG22 ' CA ' ' A' ' 100' ' ' GLY . 2.6 mt -77.88 123.21 34.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.276 -179.846 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.68 ' O ' ' HB3' ' A' ' 97' ' ' ALA . . . -145.28 -151.52 5.43 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.515 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.68 ' HB3' ' O ' ' A' ' 96' ' ' GLY . . . 85.17 72.49 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.807 0.337 . . . . 0.0 111.136 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 92.04 -59.27 2.77 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.515 -179.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.446 ' O ' ' HD2' ' A' ' 101' ' ' ARG . 0.0 OUTLIER -163.82 56.96 0.17 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.865 0.364 . . . . 0.0 110.97 -179.966 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 0.735 ' CA ' HG22 ' A' ' 95' ' ' ILE . . . -80.88 -40.1 12.48 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.435 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.458 ' O ' ' O ' ' A' ' 100' ' ' GLY . 0.0 OUTLIER 55.15 115.89 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.833 0.349 . . . . 0.0 110.863 -179.941 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.586 ' N ' HD13 ' A' ' 102' ' ' ILE . 2.2 mm -44.98 94.36 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.121 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.419 ' N ' ' O ' ' A' ' 101' ' ' ARG . 15.5 t -76.65 149.37 36.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.909 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.418 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 92.5 m -132.75 102.69 5.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.961 -179.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 14.8 t -84.81 143.0 29.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.061 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.584 ' HA ' ' CE3' ' A' ' 90' ' ' TRP . 7.3 tt -70.94 140.36 18.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.053 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -103.97 145.54 29.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.115 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -125.18 14.26 8.37 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.955 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 3.1 ttp180 . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.263 -0.875 . . . . 0.0 110.899 -179.95 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 58.4 p . . . . . 0 N--CA 1.485 1.323 0 CA-C-O 120.819 0.342 . . . . 0.0 111.232 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.413 ' HB2' ' HD2' ' A' ' 19' ' ' PRO . 0.0 OUTLIER -159.83 156.63 24.68 Favored Pre-proline 0 C--N 1.33 -0.275 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.921 179.988 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.413 ' HD2' ' HB2' ' A' ' 18' ' ' LYS . 68.8 Cg_endo -74.45 -162.92 0.16 Allowed 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.785 2.323 . . . . 0.0 112.391 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.449 ' HA2' HG13 ' A' ' 30' ' ' ILE . . . 67.68 -143.64 42.41 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.844 -0.693 . . . . 0.0 112.526 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -159.68 52.41 0.35 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.861 0.362 . . . . 0.0 110.954 -179.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.586 ' N ' ' CD2' ' A' ' 27' ' ' HIS . 0.4 OUTLIER -47.88 102.78 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.886 -179.987 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -77.95 -167.24 0.95 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.846 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -43.07 -54.86 4.12 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.886 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -140.98 8.25 2.71 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.472 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.531 ' HB3' ' CE1' ' A' ' 28' ' ' TYR . 0.1 OUTLIER -127.94 131.47 49.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.79 0.328 . . . . 0.0 110.816 179.988 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . 0.586 ' CD2' ' N ' ' A' ' 22' ' ' TYR . 9.2 t-160 -117.52 88.67 2.96 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.034 -179.766 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.531 ' CE1' ' HB3' ' A' ' 26' ' ' LYS . 6.9 m-85 -79.68 161.71 25.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.888 179.864 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.532 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 4.0 mt-30 -84.73 137.4 33.24 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.618 179.721 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.668 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.9 mp -37.83 147.28 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 CA-C-O 120.904 0.383 . . . . 0.0 111.189 -179.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.471 ' HB2' ' O ' ' A' ' 30' ' ' ILE . 26.5 m-80 67.29 11.89 8.63 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.157 179.76 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.532 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 41.7 tt0 -100.33 144.55 29.2 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.785 0.326 . . . . 0.0 110.771 179.726 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 13.2 mt-30 -111.74 156.63 21.6 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.003 0.43 . . . . 0.0 111.278 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . 0.505 ' CZ3' ' HB2' ' A' ' 47' ' ' CYS . 48.3 p90 -163.06 162.67 25.93 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.641 179.836 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -106.5 124.86 50.23 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.938 0.399 . . . . 0.0 111.1 -179.725 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.485 ' N ' ' O ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -123.52 -169.95 2.03 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.595 179.642 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.3 t -150.26 131.49 14.53 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.161 179.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.607 ' HB2' HD22 ' A' ' 43' ' ' LEU . 20.2 t80 -121.77 139.85 53.08 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.506 179.752 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.453 HD13 ' HE1' ' A' ' 38' ' ' TYR . 0.4 OUTLIER 55.88 20.03 3.91 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.943 0.401 . . . . 0.0 110.387 -179.701 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 78.52 46.21 9.02 Favored Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.944 -0.646 . . . . 0.0 112.617 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.425 ' O ' ' C ' ' A' ' 42' ' ' ALA . 35.6 m-80 -151.32 132.21 14.19 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.808 0.337 . . . . 0.0 110.969 179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.425 ' C ' ' O ' ' A' ' 41' ' ' ASN . . . -36.04 147.59 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.982 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.607 HD22 ' HB2' ' A' ' 38' ' ' TYR . 1.8 tp -159.53 147.28 17.2 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.07 -179.842 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.507 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 3.2 t -122.21 131.56 72.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.6 179.7 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.57 ' SG ' ' CD1' ' A' ' 54' ' ' PHE . 0.8 OUTLIER -117.47 152.42 35.07 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.268 -179.678 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.455 ' O ' ' CE1' ' A' ' 48' ' ' TYR . 88.4 m -138.78 112.76 8.53 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.02 179.83 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.505 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 8.7 t -77.05 134.58 38.74 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.947 179.898 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.466 ' O ' ' CG2' ' A' ' 30' ' ' ILE . 2.0 m-85 -106.84 -45.34 4.21 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.926 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.576 ' CA ' HG23 ' A' ' 30' ' ' ILE . . . 117.89 -172.52 14.42 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.508 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 41.42 -112.11 0.35 Allowed Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.571 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -110.64 -21.15 12.26 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.799 0.333 . . . . 0.0 111.017 -179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 3.8 mtt180 -47.6 -29.84 3.2 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.824 179.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 64.6 -124.67 29.63 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.728 -0.748 . . . . 0.0 112.599 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.57 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 8.1 p90 -155.98 155.04 32.06 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.83 0.348 . . . . 0.0 110.864 -179.817 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -124.43 132.63 53.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.719 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.507 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.1 OUTLIER -112.42 160.96 17.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.114 -179.915 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 178.36 171.93 0.72 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.917 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 79.1 p -59.44 116.16 3.77 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.931 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.417 ' C ' ' HD3' ' A' ' 59' ' ' LYS . 0.0 OUTLIER -46.76 136.37 7.77 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.973 179.922 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -46.04 124.39 7.31 Favored 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.758 2.305 . . . . 0.0 112.427 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.17 -52.21 9.05 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.921 -179.866 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.714 ' HB1' ' CB ' ' A' ' 97' ' ' ALA . . . -165.28 133.81 3.26 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.152 -179.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -60.48 169.0 1.88 Allowed 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.146 -179.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -106.06 79.23 1.38 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.806 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.495 ' OG1' ' N ' ' A' ' 66' ' ' CYS . 0.1 OUTLIER -168.9 174.41 6.46 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.185 -179.948 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.495 ' N ' ' OG1' ' A' ' 65' ' ' THR . 1.6 p 173.93 105.06 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.856 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.401 ' CE1' ' HA2' ' A' ' 72' ' ' GLY . 85.3 t80 -62.36 117.46 6.16 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.91 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . 0.489 ' HB2' ' O ' ' A' ' 73' ' ' ASN . 6.1 t0 -89.14 78.87 7.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.865 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.417 ' C ' ' O ' ' A' ' 68' ' ' ASP . 9.4 pttp -36.08 -31.55 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.849 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.473 ' N ' ' O ' ' A' ' 68' ' ' ASP . 5.2 m-85 -40.79 -56.16 2.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.965 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.551 HG21 HD22 ' A' ' 73' ' ' ASN . 12.8 t -126.8 -36.21 2.23 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.166 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . 0.401 ' HA2' ' CE1' ' A' ' 67' ' ' PHE . . . 125.11 10.6 4.62 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.669 -0.777 . . . . 0.0 112.53 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . 0.551 HD22 HG21 ' A' ' 71' ' ' THR . 66.5 m-20 -97.06 140.25 31.85 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.827 0.346 . . . . 0.0 110.848 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 4.1 t -103.92 140.96 36.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.084 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 19.7 m-85 -126.42 -178.62 4.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.797 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -78.48 124.73 28.46 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.87 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.477 HG13 ' N ' ' A' ' 78' ' ' GLY . 8.9 p -46.43 -42.68 5.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.175 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.477 ' N ' HG13 ' A' ' 77' ' ' VAL . . . -86.85 38.34 3.13 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.496 179.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -123.34 139.52 53.95 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.814 0.34 . . . . 0.0 110.894 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 24.1 p -111.99 109.32 19.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.093 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.415 ' C ' ' OD1' ' A' ' 91' ' ' ASP . 6.4 p90 -121.04 143.34 49.11 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.834 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.412 ' HA ' ' HA ' ' A' ' 91' ' ' ASP . 50.0 mt-10 -85.15 175.08 9.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.928 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.443 ' HA ' ' HD2' ' A' ' 84' ' ' PRO . 0.0 OUTLIER -164.98 111.12 0.83 Allowed Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.792 179.952 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.443 ' HD2' ' HA ' ' A' ' 83' ' ' ARG . 25.0 Cg_endo -62.2 137.38 65.78 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 122.718 2.278 . . . . 0.0 112.277 -179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -171.77 132.41 0.72 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.901 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 54.71 -160.36 0.16 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.911 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.2 p -89.64 33.71 0.84 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.87 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.506 ' O ' ' NE1' ' A' ' 90' ' ' TRP . 2.6 ttm -162.71 129.54 3.57 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.823 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 1.3 mt -91.67 133.6 32.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.205 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . 0.995 ' CZ3' HD11 ' A' ' 106' ' ' ILE . 0.0 OUTLIER -127.5 123.44 35.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.912 179.891 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.415 ' OD1' ' C ' ' A' ' 81' ' ' TYR . 41.8 t0 -76.61 102.02 5.96 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.931 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . 0.5 ' HA ' ' HA ' ' A' ' 104' ' ' CYS . 1.1 m -81.21 117.48 21.77 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.01 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 30.3 m -88.33 127.64 35.48 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.018 179.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.404 ' O ' ' HA ' ' A' ' 77' ' ' VAL . 0.1 OUTLIER -68.22 86.2 0.27 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.914 -179.919 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 1.2 mt -99.33 61.58 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.352 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.44 ' O ' ' HB3' ' A' ' 97' ' ' ALA . . . -96.71 -114.27 3.07 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.703 -0.76 . . . . 0.0 112.549 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.714 ' CB ' ' HB1' ' A' ' 62' ' ' ALA . . . 68.08 20.75 8.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.95 0.405 . . . . 0.0 111.112 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 156.02 -52.58 0.43 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.722 -0.752 . . . . 0.0 112.327 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.438 ' CG ' ' O ' ' A' ' 99' ' ' ARG . 0.0 OUTLIER -133.12 94.12 3.3 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.826 0.346 . . . . 0.0 110.873 179.993 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -36.72 98.35 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.835 -0.698 . . . . 0.0 112.552 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -117.66 48.95 1.28 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.756 0.313 . . . . 0.0 110.813 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.576 ' H ' HD12 ' A' ' 102' ' ' ILE . 2.2 mp -56.22 102.55 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.192 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 32.5 t -98.6 129.42 45.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.738 179.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.5 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 0.7 OUTLIER -99.53 148.41 24.3 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.97 0.414 . . . . 0.0 111.033 -179.888 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -157.05 112.48 2.85 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.061 -179.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.995 HD11 ' CZ3' ' A' ' 90' ' ' TRP . 3.3 mp -40.3 131.95 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.173 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -96.27 108.56 21.07 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.083 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 3.8 p30 -132.08 36.21 3.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.906 -179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 9.2 mtp85 . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.945 -179.955 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 12.9 t . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.794 0.331 . . . . 0.0 111.22 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 9.3 mtmt 63.81 147.53 0.1 OUTLIER Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.992 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -65.8 173.55 6.74 Favored 'Trans proline' 0 C--O 1.231 0.163 0 C-N-CA 122.751 2.301 . . . . 0.0 112.275 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 95.4 177.76 37.18 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.678 -0.772 . . . . 0.0 112.384 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 69.6 m -112.58 126.58 55.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.81 0.338 . . . . 0.0 110.877 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 15.0 t80 -119.39 121.47 39.6 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.975 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.423 ' O ' ' C ' ' A' ' 24' ' ' ASN . 2.0 t0 -99.33 -162.5 0.96 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.942 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.423 ' C ' ' O ' ' A' ' 23' ' ' ASP . 7.9 t-20 -35.81 -53.14 0.73 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.954 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -153.64 20.76 0.7 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.588 -179.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.42 ' HB3' ' CE2' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -121.41 132.66 54.88 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.889 0.376 . . . . 0.0 110.952 179.868 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 13.5 t-160 -115.0 91.56 3.65 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.096 -179.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.463 ' HB3' ' OE1' ' A' ' 32' ' ' GLN . 0.1 OUTLIER -83.15 -178.39 7.09 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.929 179.915 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.524 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 1.7 tt0 -114.21 152.41 31.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.548 179.636 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.688 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.4 mp -49.47 154.03 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-N 116.42 -0.355 . . . . 0.0 111.153 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 10.7 m-20 59.53 17.95 6.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.02 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.524 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 2.2 tt0 -105.25 142.54 34.84 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.81 179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.428 ' CG ' HG23 ' A' ' 46' ' ' THR . 24.9 mt-30 -115.93 140.71 48.97 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.05 -179.76 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . 0.604 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 39.6 p90 -148.5 -173.34 4.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.807 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.671 ' OE2' ' HB1' ' A' ' 42' ' ' ALA . 61.6 tt0 -120.01 121.67 39.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.925 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.844 ' O ' HD22 ' A' ' 43' ' ' LEU . 0.8 OUTLIER -106.81 156.45 18.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.821 179.982 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.3 m -110.09 139.43 45.23 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.678 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.491 ' N ' HD21 ' A' ' 43' ' ' LEU . 1.0 OUTLIER -155.2 110.65 3.07 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.783 179.827 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 66.56 38.2 4.22 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.613 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 65.31 44.85 92.91 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.446 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.502 ' HB2' HD11 ' A' ' 43' ' ' LEU . 19.4 m120 -135.78 175.09 9.91 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 120.811 0.338 . . . . 0.0 110.933 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.932 ' C ' HD13 ' A' ' 43' ' ' LEU . . . -117.1 104.15 10.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.905 179.834 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.932 HD13 ' C ' ' A' ' 42' ' ' ALA . 0.0 OUTLIER -114.73 118.92 34.98 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.25 -179.786 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.481 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.7 t -71.13 128.48 34.35 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.369 179.368 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.604 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 1.9 m -106.17 157.82 17.28 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.148 -179.598 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.443 ' O ' ' CE1' ' A' ' 48' ' ' TYR . 8.6 m -146.63 121.51 9.97 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.083 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.477 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 18.3 t -79.95 134.29 36.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.97 -179.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.481 ' HB2' ' HB3' ' A' ' 52' ' ' ARG . 1.4 m-85 -104.95 -45.94 4.42 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.983 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 114.13 -173.86 15.19 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.423 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 39.81 -129.92 2.54 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.535 179.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 18.0 m -102.27 26.13 8.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.767 0.318 . . . . 0.0 110.964 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.481 ' HB3' ' HB2' ' A' ' 48' ' ' TYR . 9.0 mmt180 -87.57 -47.24 8.87 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.173 -179.846 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 65.3 160.77 0.62 Allowed Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.507 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.573 ' CE1' ' SG ' ' A' ' 45' ' ' CYS . 0.6 OUTLIER -73.99 149.95 41.01 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.822 0.344 . . . . 0.0 110.835 -179.993 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -112.38 -45.86 3.23 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.966 -179.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.481 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.1 OUTLIER 72.39 146.16 0.08 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.889 -179.966 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.408 ' CG ' ' N ' ' A' ' 58' ' ' SER . 0.9 OUTLIER -124.48 -89.94 0.57 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.933 179.958 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.497 ' HA ' ' HA ' ' A' ' 43' ' ' LEU . 67.4 m -165.45 177.34 7.54 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.713 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.486 ' HB2' ' HB3' ' A' ' 42' ' ' ALA . 0.7 OUTLIER -75.53 109.14 7.05 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.793 179.983 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.47 ' HD3' ' O ' ' A' ' 58' ' ' SER . 57.6 Cg_endo -71.12 -178.16 2.71 Favored 'Trans proline' 0 C--O 1.231 0.149 0 C-N-CA 122.751 2.301 . . . . 0.0 112.445 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -143.77 57.48 1.35 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.739 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . 56.0 -169.98 0.08 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.071 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.421 ' HG3' ' N ' ' A' ' 64' ' ' GLU . 1.1 tt0 -109.75 150.12 28.8 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.592 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.421 ' N ' ' HG3' ' A' ' 63' ' ' GLU . 16.8 tt0 -127.13 51.18 1.91 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.964 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -165.91 143.64 5.62 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.114 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 5.1 m -124.59 -172.17 2.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.766 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.565 ' CE2' ' HA ' ' A' ' 69' ' ' LYS . 87.8 t80 -161.78 118.59 2.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.067 179.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . 0.428 ' O ' ' C ' ' A' ' 69' ' ' LYS . 3.7 t0 -92.22 76.79 5.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.728 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.565 ' HA ' ' CE2' ' A' ' 67' ' ' PHE . 1.3 ptmt -35.18 -35.85 0.05 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.984 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.418 ' N ' ' O ' ' A' ' 68' ' ' ASP . 18.6 m-30 -40.29 -57.24 1.79 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.911 179.875 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 20.5 p -140.48 32.33 1.87 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.105 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 46.36 95.45 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.54 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . 0.477 ' O ' ' HA ' ' A' ' 67' ' ' PHE . 2.0 m-80 -147.18 162.88 37.98 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.792 0.33 . . . . 0.0 110.983 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -132.87 104.59 6.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.154 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.592 ' CD2' ' CE1' ' A' ' 81' ' ' TYR . 0.7 OUTLIER -108.45 13.54 25.38 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.882 -179.926 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.427 ' O ' ' O ' ' A' ' 75' ' ' TYR . 70.9 mtt85 49.15 178.71 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.767 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.703 ' O ' HG22 ' A' ' 77' ' ' VAL . 12.2 p -95.53 28.17 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.153 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -146.44 14.15 1.61 Allowed Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.424 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -134.01 127.53 32.49 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.811 0.338 . . . . 0.0 111.02 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.654 HG22 ' CG2' ' A' ' 93' ' ' THR . 22.2 p -92.51 164.16 13.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.118 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.592 ' CE1' ' CD2' ' A' ' 75' ' ' TYR . 47.9 p90 -158.55 166.1 32.93 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.92 -179.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -117.18 116.32 27.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.804 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 20.8 mmt-85 -118.23 117.05 35.24 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.946 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -71.96 106.94 2.11 Favored 'Trans proline' 0 C--N 1.342 0.222 0 C-N-CA 122.7 2.267 . . . . 0.0 112.291 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.463 ' O ' ' CB ' ' A' ' 86' ' ' ASP . 1.5 mmpp? -117.61 107.87 14.76 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.876 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.463 ' CB ' ' O ' ' A' ' 85' ' ' LYS . 0.4 OUTLIER 81.85 -153.7 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.801 -179.965 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -81.11 6.95 12.2 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.067 179.904 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 1.4 tpt -137.92 149.22 46.01 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.861 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.53 ' C ' ' CD1' ' A' ' 90' ' ' TRP . 1.4 mt -110.36 154.2 11.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.198 -179.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . 0.631 ' CD1' ' N ' ' A' ' 90' ' ' TRP . 0.1 OUTLIER -143.23 150.04 38.77 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.776 179.912 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.451 ' OD1' ' HB3' ' A' ' 108' ' ' ASN . 0.2 OUTLIER -83.28 65.38 8.25 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.323 -0.399 . . . . 0.0 110.957 179.979 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . 0.41 ' HA ' ' HA ' ' A' ' 104' ' ' CYS . 21.4 m -48.12 137.14 10.89 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.111 179.928 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.654 ' CG2' HG22 ' A' ' 80' ' ' THR . 18.3 m -145.08 137.52 26.04 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.068 179.878 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.404 ' HB2' ' CD1' ' A' ' 75' ' ' TYR . 5.1 t -74.42 71.82 1.81 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.942 -179.827 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.51 HG22 ' O ' ' A' ' 95' ' ' ILE . 2.3 mt -81.25 66.66 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.296 -179.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.638 ' O ' ' HB3' ' A' ' 97' ' ' ALA . . . 153.1 -83.24 0.16 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.375 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.638 ' HB3' ' O ' ' A' ' 96' ' ' GLY . . . 80.18 80.71 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.803 0.335 . . . . 0.0 111.137 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 86.54 0.02 86.58 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.589 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 17.9 mtp85 -139.73 -55.53 0.56 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.814 0.34 . . . . 0.0 110.981 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 0.427 ' O ' ' HB3' ' A' ' 101' ' ' ARG . . . -85.61 -103.96 0.7 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.473 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.427 ' HB3' ' O ' ' A' ' 100' ' ' GLY . 0.0 OUTLIER 179.73 169.51 1.15 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.766 0.317 . . . . 0.0 110.895 -179.925 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 3.7 mt -97.1 64.77 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.079 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 19.2 t -45.42 155.95 0.13 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.852 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.41 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 81.1 m -150.97 96.36 2.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.945 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . 0.441 ' O ' ' N ' ' A' ' 91' ' ' ASP . 0.1 OUTLIER -91.37 150.89 21.08 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.129 -179.965 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.498 HG13 ' CE3' ' A' ' 90' ' ' TRP . 2.3 mp -65.79 144.5 14.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.048 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . 43.64 -163.9 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.086 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . 0.464 ' OD1' ' N ' ' A' ' 108' ' ' ASN . 4.7 p-10 -146.95 157.25 43.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.83 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . 0.448 ' HG2' ' O ' ' A' ' 108' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.181 -0.914 . . . . 0.0 110.959 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 23.3 t . . . . . 0 N--CA 1.486 1.331 0 CA-C-O 120.843 0.354 . . . . 0.0 111.218 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -143.83 109.74 5.16 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.899 179.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 87.4 Cg_endo -78.06 159.86 30.26 Favored 'Trans proline' 0 N--CA 1.464 -0.263 0 C-N-CA 122.812 2.341 . . . . 0.0 112.312 -179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.416 ' HA3' ' CE1' ' A' ' 27' ' ' HIS . . . 138.36 -151.72 21.63 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.665 -0.779 . . . . 0.0 112.615 179.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -158.07 64.83 0.45 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.852 0.358 . . . . 0.0 110.831 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -45.46 137.89 4.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.841 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -162.99 119.82 1.88 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.891 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.404 ' O ' ' CG ' ' A' ' 24' ' ' ASN . 36.6 t30 54.79 30.4 13.59 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.919 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 85.64 -10.33 65.11 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.539 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.84 128.19 39.98 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.813 0.34 . . . . 0.0 110.862 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . 0.416 ' CE1' ' HA3' ' A' ' 20' ' ' GLY . 28.6 t-80 -115.28 94.26 4.65 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.193 -179.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -81.71 -168.97 2.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.803 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.531 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 43.1 tt0 -106.01 141.41 37.44 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.851 179.862 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.694 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.6 mp -48.97 146.14 0.96 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.252 -179.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.405 ' OD1' HG22 ' A' ' 30' ' ' ILE . 0.6 OUTLIER 67.5 12.64 9.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.901 -179.998 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.531 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 52.6 tt0 -98.65 151.63 20.49 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.637 179.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 18.9 mt-30 -114.57 152.35 31.92 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.096 -179.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . 0.56 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 43.4 p90 -153.05 179.08 9.02 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.78 179.783 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -109.74 127.73 54.81 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.866 0.365 . . . . 0.0 111.305 -179.662 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.521 ' O ' ' N ' ' A' ' 43' ' ' LEU . 39.5 ttt-85 -133.4 171.67 13.74 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.341 179.631 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.433 ' HG1' ' C ' ' A' ' 41' ' ' ASN . 1.5 t -135.29 139.88 44.71 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.782 0.325 . . . . 0.0 111.352 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.487 ' HB2' HD22 ' A' ' 43' ' ' LEU . 3.6 t80 -126.79 126.61 43.7 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.638 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.456 HD13 ' HA ' ' A' ' 39' ' ' LEU . 2.9 mm? 63.11 25.78 15.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.574 -179.734 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 76.22 43.07 21.97 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 121.041 -0.599 . . . . 0.0 112.667 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.433 ' C ' ' HG1' ' A' ' 37' ' ' THR . 32.6 m120 -145.56 129.86 17.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.796 0.331 . . . . 0.0 111.074 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.429 ' C ' ' O ' ' A' ' 41' ' ' ASN . . . -37.5 153.98 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.458 179.687 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.521 ' N ' ' O ' ' A' ' 36' ' ' ARG . 4.4 tp -169.52 161.34 9.59 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.082 0.468 . . . . 0.0 111.618 -179.527 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.492 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 19.6 t -124.36 155.88 32.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.232 179.267 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.57 ' SG ' ' CD1' ' A' ' 54' ' ' PHE . 0.5 OUTLIER -139.46 150.46 45.22 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.939 0.4 . . . . 0.0 111.423 -179.618 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 97.9 m -133.89 115.98 15.08 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.811 179.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.507 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 36.9 t -71.73 156.35 39.44 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.971 -179.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.524 ' O ' ' CG2' ' A' ' 30' ' ' ILE . 42.3 m-85 -119.25 -53.28 2.25 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.151 -179.787 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.495 ' HA2' HG23 ' A' ' 30' ' ' ILE . . . 156.82 52.49 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.456 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 48.63 50.21 25.69 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.526 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -149.4 -61.6 0.22 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.832 0.349 . . . . 0.0 110.842 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.524 ' NE ' ' HA ' ' A' ' 52' ' ' ARG . 8.5 mmm180 -68.46 -31.6 71.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.781 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . 0.577 ' O ' ' CD2' ' A' ' 54' ' ' PHE . . . 88.02 24.3 35.33 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 120.881 -0.676 . . . . 0.0 112.533 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.577 ' CD2' ' O ' ' A' ' 53' ' ' GLY . 1.5 p90 56.04 151.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.943 0.402 . . . . 0.0 111.106 179.839 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.401 ' O ' ' OD1' ' A' ' 55' ' ' ASN . 43.6 p-10 -130.44 109.38 10.67 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.64 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.492 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.7 OUTLIER -83.73 170.06 14.6 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.103 -179.855 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 172.31 166.76 0.11 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.963 -179.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.438 ' HA ' HD12 ' A' ' 43' ' ' LEU . 5.0 t -58.6 154.68 13.84 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.951 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.438 ' HG3' ' HD2' ' A' ' 60' ' ' PRO . 0.0 OUTLIER -79.97 131.89 62.04 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.835 -179.975 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.438 ' HD2' ' HG3' ' A' ' 59' ' ' LYS . 36.2 Cg_endo -65.31 -12.75 36.34 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.686 2.257 . . . . 0.0 112.264 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 10.5 tt0 38.86 46.29 1.05 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.936 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -119.14 166.69 12.62 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.177 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.522 ' OE2' ' HB2' ' A' ' 97' ' ' ALA . 0.8 OUTLIER -115.8 -21.42 9.61 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.503 -179.931 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.515 ' CB ' HG21 ' A' ' 77' ' ' VAL . 0.1 OUTLIER 179.5 -166.38 0.07 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.894 -179.968 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.422 HG23 ' C ' ' A' ' 64' ' ' GLU . 30.5 p -158.02 146.03 18.66 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.215 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.623 ' O ' HG23 ' A' ' 74' ' ' THR . 25.9 p -121.43 -175.81 3.16 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.788 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.529 ' CE1' ' HA2' ' A' ' 72' ' ' GLY . 76.6 t80 -137.78 127.79 25.77 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.922 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 33.3 t0 -92.1 92.64 8.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.909 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.476 ' HA ' ' CE2' ' A' ' 67' ' ' PHE . 0.8 OUTLIER -47.79 -25.44 1.27 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.005 -179.967 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.418 ' C ' ' O ' ' A' ' 69' ' ' LYS . 8.2 m-30 -36.27 -59.37 0.63 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.829 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -159.77 30.51 0.19 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.15 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . 0.529 ' HA2' ' CE1' ' A' ' 67' ' ' PHE . . . 71.88 74.48 0.74 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.674 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -138.45 90.83 2.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.723 0.297 . . . . 0.0 110.714 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.623 HG23 ' O ' ' A' ' 66' ' ' CYS . 34.0 m -69.11 137.32 53.34 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.146 -179.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.441 ' CD2' ' CE1' ' A' ' 81' ' ' TYR . 66.3 m-85 -126.95 155.55 42.93 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.794 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 11.5 mtp180 -84.22 127.82 34.19 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.917 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.515 HG21 ' CB ' ' A' ' 64' ' ' GLU . 43.0 t -44.72 -27.03 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.108 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -90.08 26.71 9.38 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.589 -179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -158.39 134.88 9.47 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.826 0.346 . . . . 0.0 111.0 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 5.3 t -111.17 165.28 12.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.905 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.441 ' CE1' ' CD2' ' A' ' 75' ' ' TYR . 19.1 p90 -143.73 173.86 11.31 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.892 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -148.46 110.76 4.65 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.773 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -127.3 143.56 47.63 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.963 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -68.09 139.0 45.31 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.84 2.36 . . . . 0.0 112.29 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.431 ' O ' ' O ' ' A' ' 88' ' ' MET . 0.1 OUTLIER -160.47 133.58 6.63 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.899 179.943 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.404 ' O ' ' OG ' ' A' ' 87' ' ' SER . 0.9 OUTLIER 56.48 52.16 10.31 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.906 179.989 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.404 ' OG ' ' O ' ' A' ' 86' ' ' ASP . 1.8 p 53.38 23.16 3.17 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.878 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.431 ' O ' ' O ' ' A' ' 85' ' ' LYS . 0.2 OUTLIER -150.49 143.67 24.88 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.915 179.925 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 4.4 mt -108.5 136.53 43.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.166 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . 0.796 ' CZ3' HD11 ' A' ' 106' ' ' ILE . 0.1 OUTLIER -131.18 140.86 49.98 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.74 179.955 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -79.57 52.67 1.44 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.699 179.887 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . 0.462 ' HA ' ' HA ' ' A' ' 104' ' ' CYS . 70.9 m -41.43 111.29 0.21 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.087 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.486 ' O ' ' N ' ' A' ' 95' ' ' ILE . 51.9 m -98.34 132.87 43.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.894 179.83 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 43.5 t -65.89 61.98 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.935 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.486 ' N ' ' O ' ' A' ' 93' ' ' THR . 2.5 mt -69.62 105.23 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.205 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.434 ' O ' ' HB3' ' A' ' 97' ' ' ALA . . . -142.56 -119.23 1.43 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.635 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.522 ' HB2' ' OE2' ' A' ' 63' ' ' GLU . . . 67.47 -74.35 0.07 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.831 0.348 . . . . 0.0 110.981 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -128.64 80.41 0.36 Allowed Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.827 -0.702 . . . . 0.0 112.318 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 2.2 mtt-85 62.75 13.35 6.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.811 0.339 . . . . 0.0 110.675 -179.795 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 0.485 ' CA ' HG22 ' A' ' 95' ' ' ILE . . . -43.72 -52.09 6.66 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.601 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.449 ' HB3' ' O ' ' A' ' 100' ' ' GLY . 0.0 OUTLIER 68.39 112.44 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.806 0.336 . . . . 0.0 110.73 -179.945 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.43 ' C ' ' O ' ' A' ' 101' ' ' ARG . 2.3 mp -34.95 151.53 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.224 -179.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 4.7 t -146.04 128.91 16.36 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.831 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.462 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 70.9 m -111.66 138.29 48.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.096 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -144.46 140.73 29.12 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.891 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.796 HD11 ' CZ3' ' A' ' 90' ' ' TRP . 2.8 mp -82.0 114.16 22.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.106 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -113.48 143.82 43.87 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.165 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 7.0 p-10 -123.61 115.57 21.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.949 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.248 0.992 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.88 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.401 ' O ' ' C ' ' A' ' 18' ' ' LYS . 4.7 t . . . . . 0 N--CA 1.487 1.405 0 CA-C-O 120.797 0.332 . . . . 0.0 111.165 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.401 ' C ' ' O ' ' A' ' 17' ' ' SER . 0.9 OUTLIER 38.35 71.19 1.12 Allowed Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.868 179.922 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -52.35 142.88 45.78 Favored 'Trans proline' 0 N--CA 1.465 -0.193 0 C-N-CA 122.758 2.305 . . . . 0.0 112.206 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.417 ' C ' ' SG ' ' A' ' 21' ' ' CYS . . . 160.99 -153.26 24.06 Favored Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.701 -0.761 . . . . 0.0 112.482 -179.833 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.417 ' SG ' ' C ' ' A' ' 20' ' ' GLY . 0.0 OUTLIER -159.82 93.0 1.06 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.844 0.354 . . . . 0.0 110.828 179.985 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.468 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 6.5 t80 -96.26 101.34 12.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.96 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.494 ' OD2' ' CE2' ' A' ' 54' ' ' PHE . 9.5 t70 -128.4 133.72 48.66 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.858 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 45.6 t30 51.66 28.44 4.77 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.015 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 86.61 -2.22 87.28 Favored Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.519 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.592 ' HB3' ' CZ ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -95.7 137.84 34.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.831 0.348 . . . . 0.0 110.95 179.913 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 2.4 t-80 -114.37 85.76 2.29 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.906 -179.794 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.592 ' CZ ' ' HB3' ' A' ' 26' ' ' LYS . 2.3 m-85 -79.64 176.48 9.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.961 -179.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.513 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 1.2 tt0 -104.09 136.91 42.84 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.56 179.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.67 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.8 mp -40.76 146.85 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.33 -179.877 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.461 ' HB2' ' O ' ' A' ' 30' ' ' ILE . 69.7 m-80 67.9 10.68 7.95 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.303 179.71 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.513 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 59.9 tt0 -94.62 149.29 21.39 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.806 0.336 . . . . 0.0 110.828 179.79 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.424 ' CG ' HG23 ' A' ' 46' ' ' THR . 19.2 mt-30 -113.38 147.19 38.2 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.209 -179.744 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . 0.519 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 42.6 p90 -157.27 -164.45 1.59 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.494 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.64 ' OE1' ' HB1' ' A' ' 42' ' ' ALA . 1.4 tm-20 -128.89 122.73 30.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.86 0.362 . . . . 0.0 111.191 -179.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.666 ' O ' HD22 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -114.92 131.19 56.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.546 179.751 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.4 m -99.83 129.41 45.93 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.681 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.474 ' O ' ' HB2' ' A' ' 39' ' ' LEU . 1.5 t80 -145.14 112.59 6.18 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.854 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.474 ' HB2' ' O ' ' A' ' 38' ' ' TYR . 0.3 OUTLIER 77.74 56.97 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.658 -179.924 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 48.91 28.94 7.77 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.357 -179.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 34.7 m-80 -140.45 138.85 35.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.795 0.331 . . . . 0.0 110.995 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 1.029 ' C ' HD13 ' A' ' 43' ' ' LEU . . . -87.81 126.43 35.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.169 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 1.029 HD13 ' C ' ' A' ' 42' ' ' ALA . 0.0 OUTLIER -124.34 123.03 39.31 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.306 -0.407 . . . . 0.0 111.175 -179.965 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.48 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.7 t -67.15 133.24 31.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.337 -0.392 . . . . 0.0 109.972 179.17 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.571 ' SG ' ' CD1' ' A' ' 54' ' ' PHE . 1.6 m -115.0 167.35 10.88 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.05 0.452 . . . . 0.0 111.76 -179.037 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.497 ' O ' ' CE1' ' A' ' 48' ' ' TYR . 7.2 m -157.96 118.34 3.39 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.773 -0.648 . . . . 0.0 110.697 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.493 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 12.4 t -78.27 136.05 37.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.207 -179.584 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.501 ' HB2' ' HB2' ' A' ' 52' ' ' ARG . 5.4 m-85 -111.07 -32.29 6.84 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.908 179.848 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 76.6 -170.82 54.98 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.696 -0.764 . . . . 0.0 112.486 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . 0.526 ' O ' ' CB ' ' A' ' 51' ' ' SER . . . 54.4 25.46 34.08 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.522 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.526 ' CB ' ' O ' ' A' ' 50' ' ' GLY . 3.2 m 85.06 -13.29 0.67 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.835 0.35 . . . . 0.0 111.157 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.501 ' HB2' ' HB2' ' A' ' 48' ' ' TYR . 60.7 mtt180 -57.58 -28.85 63.97 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.929 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 58.74 168.65 0.2 Allowed Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.454 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.571 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 7.6 p90 -84.11 146.66 27.78 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.765 0.316 . . . . 0.0 110.815 -179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -101.95 -47.82 4.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.018 -179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.49 ' HA ' ' HA ' ' A' ' 45' ' ' CYS . 0.1 OUTLIER 71.31 159.42 0.21 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.813 -179.881 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.4 ' CG ' ' N ' ' A' ' 58' ' ' SER . 1.5 tp10 -141.65 -93.5 0.14 Allowed 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.15 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.506 ' HA ' ' HA ' ' A' ' 43' ' ' LEU . 21.7 m -171.63 160.96 5.98 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.88 0.371 . . . . 0.0 111.02 -179.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.455 ' HG2' ' HD2' ' A' ' 60' ' ' PRO . 11.7 tmtt? -126.61 133.32 24.88 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.804 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.455 ' HD2' ' HG2' ' A' ' 59' ' ' LYS . 83.2 Cg_exo -44.92 110.98 0.26 Allowed 'Trans proline' 0 N--CA 1.464 -0.261 0 C-N-CA 122.811 2.341 . . . . 0.0 112.399 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -49.69 -22.31 1.32 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.961 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -72.56 105.29 4.15 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.117 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.447 ' HG3' ' N ' ' A' ' 64' ' ' GLU . 1.9 tt0 -113.38 163.49 14.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.544 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.447 ' N ' ' HG3' ' A' ' 63' ' ' GLU . 13.6 tt0 -169.46 46.07 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.933 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.622 HG22 ' CG2' ' A' ' 74' ' ' THR . 0.0 OUTLIER -142.15 166.5 24.54 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.211 179.907 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.521 ' HA ' ' CA ' ' A' ' 98' ' ' GLY . 3.8 m -149.95 -176.03 5.28 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.917 -179.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.577 ' CE2' ' HA2' ' A' ' 72' ' ' GLY . 27.8 t80 -178.61 93.62 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.887 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . 0.468 ' O ' ' O ' ' A' ' 69' ' ' LYS . 13.6 t70 -93.98 38.18 1.08 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.928 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.471 ' HA ' ' CE1' ' A' ' 67' ' ' PHE . 1.3 pttt 36.6 -159.73 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.953 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.458 ' HB2' ' O ' ' A' ' 69' ' ' LYS . 21.9 m-85 73.32 -54.71 0.69 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.964 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 13.2 p -135.14 12.97 3.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.027 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . 0.577 ' HA2' ' CE2' ' A' ' 67' ' ' PHE . . . 46.43 24.63 1.72 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.564 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . 0.463 ' HB3' ' CE1' ' A' ' 75' ' ' TYR . 1.1 t-20 -72.21 109.6 6.07 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.758 0.314 . . . . 0.0 110.929 -179.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.622 ' CG2' HG22 ' A' ' 65' ' ' THR . 92.3 m -78.48 112.11 15.2 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.015 179.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.659 ' CE2' ' CE2' ' A' ' 81' ' ' TYR . 9.1 m-85 -94.37 -175.77 3.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.898 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.447 ' HD2' ' HA ' ' A' ' 76' ' ' ARG . 0.2 OUTLIER -104.61 126.46 51.72 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.819 179.991 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.596 HG23 ' N ' ' A' ' 65' ' ' THR . 31.9 t -62.62 -14.94 14.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.213 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -102.39 16.2 55.4 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.475 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -155.69 163.74 39.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.812 0.339 . . . . 0.0 110.922 -179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.462 HG22 HG23 ' A' ' 93' ' ' THR . 30.6 p -95.99 167.39 11.26 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.217 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.659 ' CE2' ' CE2' ' A' ' 75' ' ' TYR . 15.6 p90 -146.2 131.68 18.7 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.858 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.608 ' OE2' HG22 ' A' ' 89' ' ' ILE . 0.8 OUTLIER -70.96 113.32 7.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.02 -179.951 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.511 ' NE ' ' HA ' ' A' ' 83' ' ' ARG . 0.7 OUTLIER -120.71 81.22 32.88 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.768 179.822 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_exo -44.58 116.6 1.15 Allowed 'Trans proline' 0 N--CA 1.465 -0.173 0 C-N-CA 122.877 2.385 . . . . 0.0 112.433 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -132.66 122.11 24.15 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.897 179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 3.7 t0 72.84 -156.53 0.08 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.84 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -82.17 8.04 12.01 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.952 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -128.64 160.32 32.8 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.915 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.948 ' O ' HG23 ' A' ' 106' ' ' ILE . 2.6 mp -107.81 128.18 63.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.027 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . 0.696 ' CZ3' HD11 ' A' ' 106' ' ' ILE . 1.0 OUTLIER -122.21 136.5 54.92 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.981 -179.987 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -93.15 57.81 2.78 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.803 179.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . 0.474 ' HA ' ' HA ' ' A' ' 104' ' ' CYS . 0.7 OUTLIER -38.21 151.63 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.095 -179.94 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.462 HG23 HG22 ' A' ' 80' ' ' THR . 88.7 m -128.2 128.71 45.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.977 179.887 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.436 ' HB3' ' HA ' ' A' ' 77' ' ' VAL . 16.2 t -64.66 88.3 0.06 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.233 -0.439 . . . . 0.0 111.01 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.429 ' HB ' ' O ' ' A' ' 101' ' ' ARG . 0.8 OUTLIER -101.8 46.62 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.168 179.998 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 172.64 -159.6 30.37 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.824 -0.703 . . . . 0.0 112.476 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -90.98 63.65 5.22 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.836 0.351 . . . . 0.0 111.044 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.521 ' CA ' ' HA ' ' A' ' 66' ' ' CYS . . . 68.12 10.36 59.15 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.489 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 171.59 51.32 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.838 0.351 . . . . 0.0 110.945 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -111.88 -62.13 0.46 Allowed Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.371 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.429 ' O ' ' HB ' ' A' ' 95' ' ' ILE . 0.4 OUTLIER -141.45 38.89 1.71 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.95 0.405 . . . . 0.0 110.827 179.808 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.455 HG21 ' OH ' ' A' ' 81' ' ' TYR . 2.7 mt -56.96 89.25 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.168 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.41 ' O ' ' HA ' ' A' ' 92' ' ' CYS . 27.0 t -84.71 138.72 32.48 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.791 179.882 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.474 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 0.5 OUTLIER -110.93 141.63 44.1 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.982 -179.931 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 1.5 t -156.89 121.55 4.48 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.054 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.948 HG23 ' O ' ' A' ' 89' ' ' ILE . 1.7 mp -66.48 138.84 22.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.086 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -64.65 106.2 1.13 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.167 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -105.61 111.68 24.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.876 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.252 -0.88 . . . . 0.0 110.971 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 22.7 t . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 120.836 0.351 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 3.1 mmtp -110.61 136.4 20.65 Favored Pre-proline 0 C--N 1.33 -0.264 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.94 179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -75.99 156.25 38.62 Favored 'Trans proline' 0 C--O 1.232 0.223 0 C-N-CA 122.832 2.355 . . . . 0.0 112.391 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 73.11 -154.44 49.53 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.873 -0.679 . . . . 0.0 112.455 179.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 85.0 m -138.99 135.16 34.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.837 0.351 . . . . 0.0 110.922 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 47.7 t80 -110.3 119.84 40.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.877 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -167.73 151.61 6.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.916 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.491 ' ND2' ' O ' ' A' ' 24' ' ' ASN . 17.6 t30 55.35 51.03 13.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.908 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 47.56 23.26 2.07 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.482 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.554 ' HB3' ' CE2' ' A' ' 28' ' ' TYR . 0.1 OUTLIER -132.29 139.12 48.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.842 0.353 . . . . 0.0 110.865 -179.977 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -109.23 85.9 2.19 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.947 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.554 ' CE2' ' HB3' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -79.84 165.15 23.0 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.815 179.948 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.523 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 0.0 OUTLIER -100.25 162.33 13.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.741 179.806 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.681 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.5 mp -49.53 156.23 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.351 -179.868 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.43 ' N ' HG22 ' A' ' 30' ' ' ILE . 1.7 m-80 56.86 19.65 4.66 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.066 179.846 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.523 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 10.1 tt0 -101.29 147.69 26.0 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.825 0.345 . . . . 0.0 110.91 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 14.2 mt-30 -116.75 145.46 43.47 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.016 -179.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . 0.6 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 42.0 p90 -150.35 168.88 22.79 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.785 179.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 76.2 tt0 -101.15 126.53 47.87 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.171 -179.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.471 ' HB2' ' SG ' ' A' ' 56' ' ' CYS . 1.5 mtp180 -119.4 176.95 5.1 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.674 179.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -144.61 132.46 21.31 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.701 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.524 ' HB2' HD22 ' A' ' 43' ' ' LEU . 0.6 OUTLIER -154.76 143.59 20.84 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.678 179.671 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.463 ' HB2' ' O ' ' A' ' 38' ' ' TYR . 3.4 mm? 66.76 22.51 10.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.484 -179.678 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 69.69 38.85 77.74 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.531 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 -152.08 153.3 33.66 Favored 'General case' 0 N--CA 1.452 -0.325 0 CA-C-O 120.708 0.29 . . . . 0.0 110.984 -179.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.88 ' O ' HD12 ' A' ' 43' ' ' LEU . . . -60.75 146.58 45.44 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.946 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.88 HD12 ' O ' ' A' ' 42' ' ' ALA . 4.3 mp -142.18 161.5 37.84 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.929 0.395 . . . . 0.0 111.364 -179.674 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.499 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.2 t -128.9 123.65 59.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.244 179.353 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.6 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 1.3 m -109.8 158.76 17.81 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.618 -179.263 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 24.7 m -146.38 119.53 8.86 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.797 179.644 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.544 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 28.7 t -74.16 143.69 45.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.158 -179.795 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.461 ' N ' ' O ' ' A' ' 53' ' ' GLY . 26.2 m-85 -119.4 -24.66 6.27 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.948 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 123.87 -169.07 15.98 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.453 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . 0.516 ' O ' ' CB ' ' A' ' 51' ' ' SER . . . -75.17 85.94 0.8 Allowed Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.601 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.516 ' CB ' ' O ' ' A' ' 50' ' ' GLY . 0.3 OUTLIER 160.0 -62.91 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.823 0.344 . . . . 0.0 110.849 179.976 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -85.07 -29.94 24.49 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.024 -179.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . 0.461 ' O ' ' N ' ' A' ' 48' ' ' TYR . . . 70.34 -111.51 3.82 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.522 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.566 ' CE1' ' SG ' ' A' ' 45' ' ' CYS . 1.8 p90 -153.65 154.21 33.74 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.893 0.378 . . . . 0.0 110.886 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -133.2 93.96 3.26 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.622 179.777 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.499 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.4 OUTLIER -68.0 166.79 15.13 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.146 -179.673 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.491 ' HG2' ' N ' ' A' ' 58' ' ' SER . 14.6 tt0 -152.75 -89.69 0.05 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.131 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.491 ' N ' ' HG2' ' A' ' 57' ' ' GLU . 0.1 OUTLIER -164.49 -167.18 1.22 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.976 179.953 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.45 ' O ' ' O ' ' A' ' 60' ' ' PRO . 0.0 OUTLIER -164.47 110.78 0.88 Allowed Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.972 -179.948 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.45 ' O ' ' O ' ' A' ' 59' ' ' LYS . 63.8 Cg_exo -51.46 -163.1 0.0 OUTLIER 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.703 2.269 . . . . 0.0 112.342 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -121.3 -66.16 1.07 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.894 179.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -125.33 163.76 21.85 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.113 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.649 ' O ' ' HB2' ' A' ' 97' ' ' ALA . 2.8 tt0 -95.19 -18.63 20.74 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.452 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -66.57 -169.02 0.07 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.826 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 7.2 p 48.01 -177.56 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.18 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.42 ' SG ' ' HB2' ' A' ' 75' ' ' TYR . 18.5 p -150.12 -156.33 0.71 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.791 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.465 ' O ' ' N ' ' A' ' 69' ' ' LYS . 12.6 t80 -168.32 81.77 0.17 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.891 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -52.74 87.08 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.872 180.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.465 ' N ' ' O ' ' A' ' 67' ' ' PHE . 2.0 pttt -52.67 -29.84 28.68 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.862 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.403 ' C ' ' O ' ' A' ' 69' ' ' LYS . 8.3 m-30 -38.4 -56.49 1.24 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.903 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -122.58 -8.08 8.55 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.09 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 80.12 69.67 1.38 Allowed Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.511 -179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 12.8 m120 -122.37 -162.88 1.03 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.942 0.401 . . . . 0.0 110.965 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 18.0 m -144.39 105.21 4.17 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.976 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.42 ' HB2' ' SG ' ' A' ' 66' ' ' CYS . 19.3 m-85 -120.68 160.38 23.42 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.747 -179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -91.58 146.56 23.69 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.797 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 93.7 t -45.59 -37.74 2.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.096 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -95.39 14.8 64.46 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.724 -0.75 . . . . 0.0 112.515 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -107.52 100.69 10.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.922 0.391 . . . . 0.0 110.996 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.876 HG22 HG23 ' A' ' 93' ' ' THR . 64.6 p -73.98 143.6 45.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.205 -179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.743 ' OH ' HG21 ' A' ' 102' ' ' ILE . 42.2 p90 -133.88 109.98 9.42 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.784 179.842 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -50.4 168.24 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.083 -179.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -167.66 86.58 0.75 Allowed Pre-proline 0 C--N 1.329 -0.324 0 CA-C-N 116.048 -0.523 . . . . 0.0 110.801 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo -69.13 91.94 0.45 Allowed 'Trans proline' 0 C--O 1.232 0.195 0 C-N-CA 122.734 2.289 . . . . 0.0 112.402 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 2.8 mttt -128.26 132.54 48.72 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.788 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 4.8 t0 74.95 10.23 3.85 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.884 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER 66.3 30.4 9.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.852 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.433 ' HG3' HG12 ' A' ' 106' ' ' ILE . 2.3 tpt -120.45 -29.91 4.67 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.919 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.448 ' C ' ' CD1' ' A' ' 90' ' ' TRP . 84.4 mt 58.77 129.02 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.057 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . 0.758 ' CH2' HD11 ' A' ' 106' ' ' ILE . 0.7 OUTLIER -136.15 132.49 36.07 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.852 -179.992 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.468 ' N ' ' O ' ' A' ' 105' ' ' THR . 0.5 OUTLIER -70.77 62.22 0.27 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.865 -179.972 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 64.2 m -51.48 136.74 25.39 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.998 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.876 HG23 HG22 ' A' ' 80' ' ' THR . 0.2 OUTLIER -126.84 124.83 40.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.912 179.872 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.52 ' HA ' HG23 ' A' ' 102' ' ' ILE . 0.5 OUTLIER -60.37 73.14 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.938 -179.897 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.517 ' N ' ' O ' ' A' ' 93' ' ' THR . 1.9 mt -88.89 58.81 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.238 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 174.24 161.85 24.91 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.481 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.649 ' HB2' ' O ' ' A' ' 63' ' ' GLU . . . -107.71 53.32 0.69 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.817 0.341 . . . . 0.0 110.961 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 95.75 -3.39 65.21 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.523 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.446 ' CG ' ' O ' ' A' ' 99' ' ' ARG . 1.9 ttm180 -173.23 40.83 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.859 0.361 . . . . 0.0 110.94 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 0.445 ' O ' ' HB3' ' A' ' 101' ' ' ARG . . . -94.82 -79.85 1.47 Allowed Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.43 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.445 ' HB3' ' O ' ' A' ' 100' ' ' GLY . 0.0 OUTLIER 171.33 51.33 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.758 0.313 . . . . 0.0 110.9 179.992 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.743 HG21 ' OH ' ' A' ' 81' ' ' TYR . 3.5 mm -37.11 97.88 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.143 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.402 ' N ' ' O ' ' A' ' 101' ' ' ARG . 3.4 t -71.92 157.49 37.76 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.948 -179.918 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 89.5 m -150.03 114.37 5.19 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.924 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . 0.468 ' O ' ' N ' ' A' ' 91' ' ' ASP . 8.8 t -129.63 154.27 47.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.19 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.758 HD11 ' CH2' ' A' ' 90' ' ' TRP . 2.9 mt -87.72 125.23 41.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.019 179.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -173.53 117.69 0.27 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.124 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -128.89 165.84 20.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.926 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 12.1 ttp180 . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.204 -0.903 . . . . 0.0 110.927 179.928 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 120.857 0.36 . . . . 0.0 111.188 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 3.4 mtmp? -153.16 127.71 4.65 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.919 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.468 ' HB2' HD11 ' A' ' 30' ' ' ILE . 73.9 Cg_endo -76.3 138.53 20.09 Favored 'Trans proline' 0 N--CA 1.463 -0.318 0 C-N-CA 122.799 2.333 . . . . 0.0 112.4 -179.911 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 114.37 162.91 14.41 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.499 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 86.9 m -116.54 115.26 25.43 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.808 0.337 . . . . 0.0 110.863 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -91.26 114.35 26.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.951 -179.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -154.59 156.05 35.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.963 -179.906 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 46.1 t30 52.36 27.11 4.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.955 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 76.07 1.02 67.05 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.666 -0.778 . . . . 0.0 112.545 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 2.5 mptt -110.96 148.59 32.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.831 0.348 . . . . 0.0 110.939 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 4.5 t-160 -117.15 88.81 2.98 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.863 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -79.64 -175.19 4.69 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.96 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.506 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 10.6 tt0 -105.92 156.55 18.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.895 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.687 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.3 mp -52.8 156.59 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.34 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.422 ' N ' HG22 ' A' ' 30' ' ' ILE . 0.4 OUTLIER 59.42 14.22 3.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.981 179.866 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.506 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 21.1 tt0 -96.06 155.09 16.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.933 179.938 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 40.4 mt-30 -122.87 134.65 54.38 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.299 -0.41 . . . . 0.0 110.981 -179.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . 0.586 ' CZ2' ' HB3' ' A' ' 45' ' ' CYS . 23.4 p90 -136.01 175.07 9.93 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.964 179.827 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -100.37 127.6 46.64 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.036 -179.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.522 ' O ' ' CB ' ' A' ' 43' ' ' LEU . 17.5 tpt85 -128.31 162.75 26.33 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.02 -0.537 . . . . 0.0 110.643 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -140.54 129.96 23.93 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.562 -179.813 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.467 ' CD1' ' HB2' ' A' ' 39' ' ' LEU . 12.3 t80 -127.73 119.25 25.38 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.914 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.467 ' HB2' ' CD1' ' A' ' 38' ' ' TYR . 3.4 tp 76.26 13.29 2.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.722 -179.824 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 84.66 39.45 8.83 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.7 180.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.42 ' O ' ' C ' ' A' ' 42' ' ' ALA . 7.5 m-80 -141.67 125.52 17.06 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.734 0.302 . . . . 0.0 110.846 179.866 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.503 ' O ' HD12 ' A' ' 43' ' ' LEU . . . -35.55 147.77 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.946 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.522 ' CB ' ' O ' ' A' ' 36' ' ' ARG . 1.1 tp -159.28 150.7 20.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.224 -179.608 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.485 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 3.1 t -122.37 135.48 62.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.358 179.541 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.586 ' HB3' ' CZ2' ' A' ' 34' ' ' TRP . 0.7 OUTLIER -118.69 157.13 28.05 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.396 -179.429 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.434 ' O ' ' CE1' ' A' ' 48' ' ' TYR . 76.1 m -140.44 116.17 10.24 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.97 179.799 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.544 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 19.4 t -75.59 132.38 40.61 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.979 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.434 ' CE1' ' O ' ' A' ' 46' ' ' THR . 7.3 m-85 -105.52 -26.04 12.06 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.749 179.883 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.446 ' N ' HG23 ' A' ' 30' ' ' ILE . . . 87.02 163.24 38.63 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.551 179.929 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 58.79 -129.99 50.4 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.529 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -96.48 -13.06 23.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.848 0.356 . . . . 0.0 110.849 -179.918 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.409 ' HB3' ' CB ' ' A' ' 48' ' ' TYR . 0.4 OUTLIER -50.41 -33.49 20.95 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.96 -179.941 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 63.72 161.02 0.35 Allowed Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.785 -0.722 . . . . 0.0 112.537 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.574 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 4.0 p90 -91.45 161.36 15.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.859 0.361 . . . . 0.0 110.851 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -139.9 120.69 14.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.871 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.485 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.8 OUTLIER -90.95 168.2 11.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.938 -179.911 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 6.5 pt-20 -176.23 -178.23 0.96 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.978 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.474 ' O ' ' HD3' ' A' ' 60' ' ' PRO . 17.3 m -80.09 160.01 25.92 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.91 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.429 ' O ' ' OE1' ' A' ' 61' ' ' GLU . 3.1 mttt -81.62 110.62 20.28 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.804 179.915 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.474 ' HD3' ' O ' ' A' ' 58' ' ' SER . 53.7 Cg_exo -51.6 96.72 0.04 OUTLIER 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.66 2.24 . . . . 0.0 112.288 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.429 ' OE1' ' O ' ' A' ' 59' ' ' LYS . 0.5 OUTLIER -112.73 24.65 12.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.988 179.909 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -129.59 127.97 41.75 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.144 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -64.97 118.35 8.96 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.129 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.412 ' O ' ' O ' ' A' ' 65' ' ' THR . 0.1 OUTLIER -68.05 -166.89 0.07 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.911 179.959 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.412 ' O ' ' O ' ' A' ' 64' ' ' GLU . 6.2 p 46.45 -175.34 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.014 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.488 ' O ' HG23 ' A' ' 74' ' ' THR . 0.5 OUTLIER -160.91 -175.17 4.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.108 -179.877 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -130.08 143.54 50.85 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.836 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . 0.511 ' O ' ' N ' ' A' ' 72' ' ' GLY . 0.5 OUTLIER -117.3 81.75 1.7 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.914 -179.925 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 28.2 pttt -44.64 -33.54 1.85 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.834 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 4.1 m-30 -44.44 -61.3 1.58 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.809 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -134.03 27.31 3.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.978 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . 0.511 ' N ' ' O ' ' A' ' 68' ' ' ASP . . . 46.51 81.86 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.745 -0.74 . . . . 0.0 112.484 179.926 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . 0.568 ' HB3' ' CZ ' ' A' ' 75' ' ' TYR . 2.5 m120 -148.18 111.86 5.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.824 0.345 . . . . 0.0 110.961 -179.922 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.488 HG23 ' O ' ' A' ' 66' ' ' CYS . 18.7 m -80.21 125.97 30.52 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.954 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.568 ' CZ ' ' HB3' ' A' ' 73' ' ' ASN . 78.2 m-85 -121.26 175.78 5.96 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.634 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.427 ' HB2' ' HB2' ' A' ' 79' ' ' ASP . 22.1 mtm180 -92.1 154.63 18.6 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.887 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.403 HG22 ' HA ' ' A' ' 97' ' ' ALA . 89.9 t -57.35 -63.32 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.127 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -83.4 51.59 4.6 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.702 -0.761 . . . . 0.0 112.474 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.427 ' HB2' ' HB2' ' A' ' 76' ' ' ARG . 10.7 t0 -147.55 125.11 11.72 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.779 0.323 . . . . 0.0 110.92 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 44.6 p -86.23 150.24 24.52 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.068 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.485 ' OH ' HG21 ' A' ' 102' ' ' ILE . 47.2 p90 -148.97 114.54 5.61 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.977 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.483 ' HG3' ' OD1' ' A' ' 91' ' ' ASP . 18.6 mt-10 -65.77 141.56 58.27 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.845 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.21 86.37 31.06 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.798 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 77.7 Cg_exo -49.93 96.8 0.03 OUTLIER 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.723 2.282 . . . . 0.0 112.354 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -121.33 136.5 54.96 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.984 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 53.2 -155.37 0.2 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.946 -179.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 7.7 t -89.2 43.96 1.18 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.996 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.555 ' O ' ' CD1' ' A' ' 90' ' ' TRP . 2.9 ttm -175.67 126.16 0.23 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.952 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 9.1 mt -87.03 128.71 39.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.037 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . 0.575 ' CZ3' HD11 ' A' ' 106' ' ' ILE . 1.2 m95 -119.92 120.45 36.42 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.912 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.483 ' OD1' ' HG3' ' A' ' 82' ' ' GLU . 0.2 OUTLIER -60.58 87.85 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.844 179.94 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 25.4 m -67.77 123.36 20.3 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.985 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.41 ' O ' ' HA ' ' A' ' 102' ' ' ILE . 82.5 m -112.23 136.45 51.63 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.914 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 44.2 t -70.08 62.58 0.21 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.053 -179.727 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.488 ' HB ' ' O ' ' A' ' 101' ' ' ARG . 2.7 mt -71.4 96.48 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.087 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.52 ' O ' ' N ' ' A' ' 98' ' ' GLY . . . 123.85 103.98 1.61 Allowed Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.806 -0.711 . . . . 0.0 112.363 -179.924 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.403 ' HA ' HG22 ' A' ' 77' ' ' VAL . . . -49.29 85.28 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.795 0.331 . . . . 0.0 111.356 -179.741 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.52 ' N ' ' O ' ' A' ' 96' ' ' GLY . . . 119.24 10.98 7.7 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.603 -0.808 . . . . 0.0 113.004 179.693 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.498 ' HB3' ' O ' ' A' ' 98' ' ' GLY . 0.1 OUTLIER 83.29 107.91 0.06 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.922 0.392 . . . . 0.0 110.838 -179.982 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 0.471 ' O ' ' HG3' ' A' ' 101' ' ' ARG . . . -150.11 -38.46 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.393 179.86 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.488 ' O ' ' HB ' ' A' ' 95' ' ' ILE . 0.7 OUTLIER -146.02 38.58 1.09 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.71 0.291 . . . . 0.0 111.041 179.913 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.485 HG21 ' OH ' ' A' ' 81' ' ' TYR . 17.6 mt -47.59 90.69 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.18 179.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.462 ' N ' ' O ' ' A' ' 101' ' ' ARG . 0.2 OUTLIER -87.24 149.33 24.66 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.916 179.926 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 3.6 m -134.6 109.22 8.51 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.921 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -106.27 143.2 34.74 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.088 -179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.575 HD11 ' CZ3' ' A' ' 90' ' ' TRP . 2.5 mp -66.48 94.34 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.117 179.938 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -128.32 113.13 15.23 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.152 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . 0.405 ' O ' ' HB3' ' A' ' 109' ' ' ARG . 21.9 t-20 -175.4 68.16 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.958 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . 0.405 ' HB3' ' O ' ' A' ' 108' ' ' ASN . 4.6 ptp180 . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.899 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 120.827 0.346 . . . . 0.0 111.189 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -38.26 97.51 0.14 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.906 179.929 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -54.82 143.39 71.21 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.643 2.229 . . . . 0.0 112.274 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 142.21 -171.88 24.43 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.55 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -159.99 110.42 1.88 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.817 0.341 . . . . 0.0 110.92 -179.94 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -90.05 140.49 29.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.916 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.451 ' OD1' ' O ' ' A' ' 26' ' ' LYS . 1.1 p-10 -126.98 -160.95 1.03 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.848 -179.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.432 ' C ' ' O ' ' A' ' 23' ' ' ASP . 0.7 OUTLIER -34.87 -52.25 0.53 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.009 -0.542 . . . . 0.0 111.068 -179.882 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -163.5 22.81 0.18 Allowed Glycine 0 N--CA 1.452 -0.244 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.62 180.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.53 ' CE ' ' HA ' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -128.95 144.82 51.3 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 120.798 0.332 . . . . 0.0 110.969 179.797 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 4.2 t-160 -119.66 85.42 2.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.302 -179.708 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.526 ' CE2' ' CG ' ' A' ' 34' ' ' TRP . 96.6 m-85 -85.01 166.3 16.83 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.833 179.818 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.514 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 0.0 OUTLIER -91.86 149.4 21.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.608 179.705 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.66 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.8 mp -41.58 147.14 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-O 120.851 0.357 . . . . 0.0 111.191 179.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.476 ' HB2' ' O ' ' A' ' 30' ' ' ILE . 70.4 m-20 67.17 11.47 8.4 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.301 179.813 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.514 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 10.2 tp60 -99.24 145.06 27.66 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.799 0.333 . . . . 0.0 110.613 179.66 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 28.0 mt-30 -112.63 156.51 22.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.173 -179.714 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . 0.571 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 48.9 p90 -160.87 173.99 14.52 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.887 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.455 ' HG3' ' O ' ' A' ' 43' ' ' LEU . 0.1 OUTLIER -99.92 141.78 32.29 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.284 -0.417 . . . . 0.0 111.113 -179.823 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.52 ' O ' ' N ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -140.36 169.81 16.98 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.724 179.886 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -137.45 125.76 23.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.769 -179.762 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.42 ' HB2' HD22 ' A' ' 43' ' ' LEU . 6.1 t80 -119.6 136.84 54.2 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.681 179.718 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.516 ' HA ' HD12 ' A' ' 39' ' ' LEU . 2.4 tp 64.24 13.1 7.66 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.693 -179.77 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 85.71 29.65 26.03 Favored Glycine 0 N--CA 1.447 -0.586 0 C-N-CA 120.933 -0.651 . . . . 0.0 112.743 179.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -133.39 145.67 50.54 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.784 0.326 . . . . 0.0 111.027 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -43.75 151.29 0.21 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.64 179.768 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.52 ' N ' ' O ' ' A' ' 36' ' ' ARG . 4.4 tp -170.24 165.59 8.96 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.951 0.405 . . . . 0.0 111.379 -179.615 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.494 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 17.7 t -132.31 151.97 35.74 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.398 179.459 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.571 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 0.5 OUTLIER -129.26 153.56 47.67 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.903 0.382 . . . . 0.0 111.423 -179.564 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 69.4 m -138.4 131.96 30.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.969 -0.56 . . . . 0.0 110.757 179.715 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.498 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 21.0 t -92.86 161.5 14.47 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.042 -179.728 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.516 ' O ' ' CG2' ' A' ' 30' ' ' ILE . 36.8 m-85 -138.62 -43.99 0.49 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.771 179.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 104.2 167.67 24.89 Favored Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.469 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 65.95 -113.38 5.7 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.812 -0.708 . . . . 0.0 112.613 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -104.29 -24.65 13.09 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.783 0.325 . . . . 0.0 110.992 -179.875 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.483 ' HB3' ' HB2' ' A' ' 48' ' ' TYR . 0.1 OUTLIER -54.99 -36.33 65.28 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.847 -179.952 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 63.48 -103.89 0.75 Allowed Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.768 -0.73 . . . . 0.0 112.549 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.552 ' CE1' ' SG ' ' A' ' 45' ' ' CYS . 1.4 p90 -158.58 166.69 31.51 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.854 0.359 . . . . 0.0 111.002 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -149.07 112.23 4.92 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.658 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.494 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.6 OUTLIER -83.4 170.93 13.99 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.121 -179.752 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 171.99 178.78 0.07 Allowed 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.965 -179.879 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 1.3 p -59.36 173.42 0.51 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.018 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.88 84.34 38.28 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.045 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_exo -55.89 98.33 0.06 OUTLIER 'Trans proline' 0 C--O 1.231 0.152 0 C-N-CA 122.846 2.364 . . . . 0.0 112.338 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.523 ' CG ' ' O ' ' A' ' 61' ' ' GLU . 8.1 tt0 -117.41 65.69 0.73 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.902 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.438 ' O ' ' O ' ' A' ' 61' ' ' GLU . . . 42.13 -169.15 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.111 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -100.83 -28.04 13.01 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.575 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.5 ' HG2' ' HG2' ' A' ' 76' ' ' ARG . 0.0 OUTLIER -92.01 117.18 29.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.894 -179.919 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -171.23 163.94 7.18 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.239 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER 175.86 171.65 0.36 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.876 -180.0 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -179.28 94.0 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.963 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . 0.583 ' HB2' ' CE2' ' A' ' 75' ' ' TYR . 38.7 t0 -69.02 81.65 0.31 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.731 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 7.3 pttm -41.75 -31.31 0.29 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.907 -179.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 8.0 m-30 -51.64 -27.36 11.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.759 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 24.0 p -137.7 -54.47 0.67 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.087 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 126.98 4.06 6.14 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.56 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . 0.528 ' HB3' ' CE1' ' A' ' 75' ' ' TYR . 2.2 m120 -70.95 149.29 46.84 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.835 0.35 . . . . 0.0 110.943 -179.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 91.7 m -103.54 117.11 33.69 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.992 179.839 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.583 ' CE2' ' HB2' ' A' ' 68' ' ' ASP . 6.5 m-85 -105.79 -160.51 0.75 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.806 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.5 ' HG2' ' HG2' ' A' ' 64' ' ' GLU . 0.0 OUTLIER -142.05 133.35 26.4 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.721 179.839 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 55.0 t -49.97 -26.21 2.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.166 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -89.12 21.79 26.07 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.418 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -145.95 135.05 22.73 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.801 0.334 . . . . 0.0 111.083 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 3.2 p -107.2 171.92 7.11 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.176 179.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 49.0 p90 -165.28 150.11 9.02 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.869 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -87.47 133.31 33.77 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.08 -179.848 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 20.3 ttp180 -132.95 73.02 76.21 Favored Pre-proline 0 C--N 1.327 -0.385 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.708 179.712 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_exo -46.5 152.34 1.54 Allowed 'Trans proline' 0 C--N 1.342 0.219 0 C-N-CA 122.797 2.332 . . . . 0.0 112.589 -179.862 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 5.7 tptp -178.77 160.34 1.15 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.822 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 54.03 35.6 22.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.921 -179.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 1.9 m 60.8 48.17 7.2 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.868 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -169.68 160.51 8.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.823 179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 2.5 mp -100.12 133.66 42.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.983 -179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . 0.524 ' CD1' ' N ' ' A' ' 90' ' ' TRP . 1.4 m95 -134.77 112.78 11.02 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.93 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -68.36 80.99 0.25 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.917 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . 0.435 ' HA ' ' HA ' ' A' ' 104' ' ' CYS . 0.6 OUTLIER -54.85 178.79 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.896 179.938 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 97.5 m -157.23 131.2 8.24 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.095 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 9.2 t -72.25 74.71 0.98 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.859 -179.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.819 HG22 ' CA ' ' A' ' 100' ' ' GLY . 1.0 OUTLIER -78.77 115.64 21.3 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.369 -179.94 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -149.45 97.5 0.18 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.512 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -159.59 61.26 0.38 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.859 0.361 . . . . 0.0 110.994 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.489 ' O ' ' CB ' ' A' ' 99' ' ' ARG . . . 72.28 8.94 71.66 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.54 -179.918 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.489 ' CB ' ' O ' ' A' ' 98' ' ' GLY . 0.0 OUTLIER 161.24 45.56 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.904 0.383 . . . . 0.0 111.012 -179.985 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 0.819 ' CA ' HG22 ' A' ' 95' ' ' ILE . . . -89.58 -52.61 2.62 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.386 179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.484 ' CD ' ' O ' ' A' ' 100' ' ' GLY . 0.0 OUTLIER 48.56 105.7 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.816 0.341 . . . . 0.0 111.107 179.926 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.42 ' C ' ' O ' ' A' ' 101' ' ' ARG . 3.6 mp -36.92 130.82 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.922 179.755 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.41 ' O ' ' HA ' ' A' ' 92' ' ' CYS . 13.2 t -127.66 159.96 33.11 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.047 -179.785 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.435 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 0.5 OUTLIER -134.15 127.45 32.07 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.801 179.94 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . 0.542 ' O ' HG23 ' A' ' 105' ' ' THR . 4.8 t -148.15 121.15 8.81 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.271 -179.86 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.464 HD11 ' CH2' ' A' ' 90' ' ' TRP . 2.7 mt -44.15 151.06 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.056 179.902 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -88.15 122.81 32.15 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.14 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -60.4 145.8 46.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.969 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 2.9 ttp180 . . . . . 0 C--O 1.25 1.088 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.893 179.984 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 6.4 t . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 120.898 0.38 . . . . 0.0 111.165 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 176.35 141.04 0.22 Allowed Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.894 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -68.38 -163.23 0.09 OUTLIER 'Trans proline' 0 N--CA 1.465 -0.172 0 C-N-CA 122.654 2.236 . . . . 0.0 112.12 179.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.463 ' CA ' HD11 ' A' ' 30' ' ' ILE . . . 101.45 137.62 9.81 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.474 -179.911 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.423 ' O ' ' CD2' ' A' ' 27' ' ' HIS . 2.0 m -84.23 151.25 24.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.781 0.324 . . . . 0.0 110.854 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 82.7 t80 -157.61 109.95 2.39 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.907 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.462 ' OD1' ' N ' ' A' ' 24' ' ' ASN . 38.8 t0 -151.48 157.85 42.86 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.923 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.462 ' N ' ' OD1' ' A' ' 23' ' ' ASP . 4.5 t-20 56.54 26.43 11.0 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.932 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 76.17 7.35 84.49 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.465 179.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.439 ' HB3' ' CE2' ' A' ' 28' ' ' TYR . 0.1 OUTLIER -116.02 141.38 48.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.856 0.36 . . . . 0.0 110.897 179.946 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . 0.423 ' CD2' ' O ' ' A' ' 21' ' ' CYS . 3.3 t-160 -113.58 89.29 3.05 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.041 -179.911 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.439 ' CE2' ' HB3' ' A' ' 26' ' ' LYS . 94.8 m-85 -87.17 145.19 26.51 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.806 179.899 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.511 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 10.4 tt0 -62.97 151.68 38.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.091 179.629 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.528 HD12 ' HA2' ' A' ' 49' ' ' GLY . 19.8 mm -50.56 144.28 2.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-O 120.935 0.397 . . . . 0.0 110.827 -179.779 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.475 ' HB2' ' O ' ' A' ' 30' ' ' ILE . 5.4 m-20 71.23 3.74 4.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.121 -179.808 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.511 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 29.7 tp60 -80.01 151.14 30.14 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.709 179.582 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.41 ' CG ' HG23 ' A' ' 46' ' ' THR . 25.2 mt-30 -115.37 142.78 46.23 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.783 179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . 0.425 ' CZ3' ' HB2' ' A' ' 47' ' ' CYS . 40.6 p90 -145.45 171.3 14.84 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.943 0.401 . . . . 0.0 111.072 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 13.8 tm-20 -100.66 140.28 35.16 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.227 -179.763 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -137.18 -167.89 2.19 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.362 179.714 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.559 ' CG2' ' N ' ' A' ' 38' ' ' TYR . 1.8 t -151.2 -51.77 0.13 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.679 0.276 . . . . 0.0 111.55 179.791 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.559 ' N ' ' CG2' ' A' ' 37' ' ' THR . 18.4 t80 44.86 104.97 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.267 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.486 ' CB ' ' O ' ' A' ' 38' ' ' TYR . 1.7 tp 82.77 15.56 0.37 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.779 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 66.13 51.68 42.65 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.81 -0.709 . . . . 0.0 112.717 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.473 ' O ' ' HA ' ' A' ' 37' ' ' THR . 62.2 m-80 -150.95 129.28 12.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.609 0.242 . . . . 0.0 110.983 179.866 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.434 ' O ' ' HA ' ' A' ' 58' ' ' SER . . . -32.96 119.43 0.32 Allowed 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.032 179.964 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.698 HD12 ' C ' ' A' ' 57' ' ' GLU . 15.0 tp -145.13 146.19 31.7 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.208 -179.529 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.488 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 4.1 t -130.62 139.07 52.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.551 179.659 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.517 ' SG ' ' CD1' ' A' ' 54' ' ' PHE . 0.4 OUTLIER -123.84 150.45 44.56 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.291 -179.626 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.545 ' O ' ' CE1' ' A' ' 48' ' ' TYR . 24.1 m -134.74 118.64 17.31 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.85 179.803 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.469 ' SG ' ' HA ' ' A' ' 30' ' ' ILE . 38.1 t -71.01 152.96 43.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.977 0.418 . . . . 0.0 110.932 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.545 ' CE1' ' O ' ' A' ' 46' ' ' THR . 5.3 m-85 -125.78 -31.26 2.94 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.133 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.528 ' HA2' HD12 ' A' ' 30' ' ' ILE . . . 89.55 179.01 45.14 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.5 179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 52.73 -113.63 2.91 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.469 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 5.9 m -111.33 -23.74 10.62 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.818 0.342 . . . . 0.0 110.939 179.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.499 ' HB2' ' HB2' ' A' ' 48' ' ' TYR . 55.8 mtm180 -50.76 -39.42 52.3 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.873 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . 0.445 ' O ' ' N ' ' A' ' 48' ' ' TYR . . . 70.53 -131.84 22.16 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.665 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.517 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 3.6 p90 -146.97 162.65 38.31 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.876 0.369 . . . . 0.0 110.961 -179.873 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.471 ' HB3' ' OH ' ' A' ' 48' ' ' TYR . 2.2 t30 -143.06 126.43 16.67 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.696 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.503 ' HB3' HD21 ' A' ' 43' ' ' LEU . 2.0 m -87.19 166.66 14.78 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.101 -179.864 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.698 ' C ' HD12 ' A' ' 43' ' ' LEU . 0.0 OUTLIER -171.32 135.58 0.96 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.901 -179.934 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.532 ' N ' HD12 ' A' ' 43' ' ' LEU . 0.1 OUTLIER -50.01 140.17 12.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.053 -179.99 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -48.4 131.53 13.26 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.783 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.468 ' O ' ' HB3' ' A' ' 61' ' ' GLU . 34.9 Cg_endo -65.26 178.46 2.01 Favored 'Trans proline' 0 C--O 1.232 0.175 0 C-N-CA 122.706 2.271 . . . . 0.0 112.284 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.493 ' CG ' ' O ' ' A' ' 61' ' ' GLU . 5.3 tm-20 66.49 12.68 8.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.857 -179.875 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.465 ' O ' ' O ' ' A' ' 61' ' ' GLU . . . 51.29 169.21 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.153 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -119.94 125.35 48.23 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.614 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.451 ' O ' ' O ' ' A' ' 65' ' ' THR . 0.0 OUTLIER -176.97 161.34 1.93 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.033 -179.969 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.472 ' O ' ' HA ' ' A' ' 97' ' ' ALA . 2.8 p 46.14 -177.84 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.308 179.889 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 24.7 p -175.14 162.7 3.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.788 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.504 ' CB ' ' HA2' ' A' ' 98' ' ' GLY . 82.3 t80 -117.97 126.24 51.95 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.042 -179.933 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -82.05 105.22 12.97 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.748 179.83 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.64 -1.21 17.96 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.162 -179.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 3.8 m-30 -94.32 -25.13 17.13 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.843 0.354 . . . . 0.0 110.862 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 1.1 p -142.45 -47.96 0.34 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.226 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 113.75 39.99 1.04 Allowed Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.741 -0.742 . . . . 0.0 112.454 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . 0.492 ' HB3' ' CZ ' ' A' ' 75' ' ' TYR . 0.8 OUTLIER -113.1 120.28 40.76 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.803 0.335 . . . . 0.0 110.788 -179.968 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 41.7 m -69.28 128.51 36.84 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.013 -179.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.492 ' CZ ' ' HB3' ' A' ' 73' ' ' ASN . 62.1 m-85 -130.97 -171.6 2.61 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.788 -179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 23.0 mtp85 -103.49 134.8 46.24 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.736 179.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 9.0 p -57.46 -22.98 18.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.138 -179.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -92.52 23.48 27.73 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.74 -0.743 . . . . 0.0 112.486 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -142.64 128.19 19.07 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.882 0.372 . . . . 0.0 110.886 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.491 ' OG1' ' N ' ' A' ' 81' ' ' TYR . 0.1 OUTLIER -101.29 176.1 5.36 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.061 179.993 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.811 ' OH ' HG21 ' A' ' 102' ' ' ILE . 33.8 p90 -154.41 138.25 16.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.861 -179.873 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.406 ' HA ' ' HA ' ' A' ' 91' ' ' ASP . 4.4 mt-10 -69.96 136.57 50.65 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.006 0.432 . . . . 0.0 110.857 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.442 ' HD3' ' HA ' ' A' ' 83' ' ' ARG . 0.0 OUTLIER -154.14 93.83 2.9 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.83 -179.935 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_endo -66.82 166.74 21.5 Favored 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.737 2.292 . . . . 0.0 112.282 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 178.45 158.73 0.51 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.888 -179.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 38.7 t0 59.28 -89.71 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.861 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 10.4 p -156.34 25.37 0.35 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.942 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.448 ' O ' ' CD1' ' A' ' 90' ' ' TRP . 0.0 OUTLIER -154.15 152.61 30.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.985 -179.926 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 7.9 mt -92.07 130.6 40.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.054 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . 0.573 ' CE3' HG13 ' A' ' 106' ' ' ILE . 0.8 OUTLIER -128.38 129.93 46.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.883 -179.944 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.406 ' HA ' ' HA ' ' A' ' 82' ' ' GLU . 0.7 OUTLIER -83.49 69.91 10.14 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.923 179.925 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . 0.461 ' HA ' ' O ' ' A' ' 103' ' ' SER . 0.8 OUTLIER -44.2 127.19 5.49 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.03 -179.954 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.507 ' O ' ' N ' ' A' ' 95' ' ' ILE . 6.0 m -105.59 120.64 42.16 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.985 179.815 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.835 ' HA ' HG23 ' A' ' 102' ' ' ILE . 0.1 OUTLIER -58.38 77.63 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.949 -179.859 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.507 ' N ' ' O ' ' A' ' 93' ' ' THR . 1.8 mt -89.87 131.59 36.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.259 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 115.38 -142.29 17.51 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.539 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.472 ' HA ' ' O ' ' A' ' 65' ' ' THR . . . -163.27 43.76 0.11 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.864 0.364 . . . . 0.0 110.939 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.504 ' HA2' ' CB ' ' A' ' 67' ' ' PHE . . . 93.43 12.6 57.0 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.537 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -167.77 38.05 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.818 0.342 . . . . 0.0 111.01 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 0.408 ' O ' ' HB3' ' A' ' 101' ' ' ARG . . . -118.96 -91.67 1.4 Allowed Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.664 -0.779 . . . . 0.0 112.491 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.408 ' HB3' ' O ' ' A' ' 100' ' ' GLY . 0.0 OUTLIER 168.49 109.67 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.867 0.365 . . . . 0.0 110.875 -179.969 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.835 HG23 ' HA ' ' A' ' 94' ' ' CYS . 1.2 mm -69.69 74.64 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.153 -179.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.461 ' O ' ' HA ' ' A' ' 92' ' ' CYS . 13.4 t -41.99 156.56 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.893 -179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.47 ' SG ' ' HB2' ' A' ' 90' ' ' TRP . 0.0 OUTLIER -138.7 97.25 3.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.902 -179.943 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 4.5 t -103.88 135.57 45.16 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.158 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.573 HG13 ' CE3' ' A' ' 90' ' ' TRP . 2.5 mp -48.99 145.07 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.011 179.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -71.35 98.43 1.77 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.086 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -137.2 136.37 38.1 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.909 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 5.5 mtt-85 . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.18 -0.914 . . . . 0.0 110.889 179.91 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.375 0 CA-C-O 120.758 0.313 . . . . 0.0 111.181 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 8.9 mttt -116.88 144.94 34.42 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.975 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_endo -69.95 152.2 68.23 Favored 'Trans proline' 0 N--CA 1.464 -0.209 0 C-N-CA 122.718 2.279 . . . . 0.0 112.271 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.57 ' N ' HD11 ' A' ' 30' ' ' ILE . . . 106.77 -164.05 13.36 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.769 -0.729 . . . . 0.0 112.538 -179.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.517 ' O ' ' CD2' ' A' ' 27' ' ' HIS . 0.2 OUTLIER -155.45 155.49 33.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.794 0.33 . . . . 0.0 110.845 -179.972 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -142.65 130.59 21.75 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.817 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.41 ' O ' ' N ' ' A' ' 26' ' ' LYS . 1.4 t0 -161.73 144.25 11.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.136 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.423 ' ND2' ' HE2' ' A' ' 26' ' ' LYS . 0.8 OUTLIER 44.81 28.79 0.38 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.232 179.782 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 85.25 -10.34 63.99 Favored Glycine 0 N--CA 1.452 -0.271 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.762 179.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.423 ' HE2' ' ND2' ' A' ' 24' ' ' ASN . 0.9 OUTLIER -89.85 140.37 29.67 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.872 0.367 . . . . 0.0 110.787 179.979 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . 0.517 ' CD2' ' O ' ' A' ' 21' ' ' CYS . 14.9 t-80 -120.1 92.34 3.76 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.257 -179.757 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.434 ' CE2' ' CD1' ' A' ' 34' ' ' TRP . 0.1 OUTLIER -83.43 165.24 19.38 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.765 179.713 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.526 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 8.7 tt0 -94.9 145.19 25.08 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.837 179.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.702 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.7 mp -48.91 150.81 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.349 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 78.8 m-20 59.84 17.24 6.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.125 179.74 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.526 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 1.1 tt0 -102.88 154.35 19.29 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.838 0.351 . . . . 0.0 110.934 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 -120.32 138.71 53.55 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.901 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . 0.555 ' CZ3' ' HB2' ' A' ' 47' ' ' CYS . 31.3 p90 -146.36 -176.93 5.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.871 179.985 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.1 tm-20 -108.79 123.46 49.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.024 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.518 ' O ' ' CB ' ' A' ' 43' ' ' LEU . 0.5 OUTLIER -131.75 167.6 19.24 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.603 179.766 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.477 ' HG1' ' C ' ' A' ' 41' ' ' ASN . 1.6 t -134.23 137.11 44.11 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.332 -0.394 . . . . 0.0 110.919 179.836 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.488 ' O ' ' CB ' ' A' ' 39' ' ' LEU . 22.1 t80 -107.74 108.54 19.81 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.874 -179.837 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.488 ' CB ' ' O ' ' A' ' 38' ' ' TYR . 6.7 tp 82.36 -49.24 0.19 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.821 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 165.16 36.94 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.795 -0.716 . . . . 0.0 112.51 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.477 ' C ' ' HG1' ' A' ' 37' ' ' THR . 68.9 m-80 -141.08 128.78 21.55 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 120.735 0.303 . . . . 0.0 111.053 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.478 ' O ' ' CD1' ' A' ' 43' ' ' LEU . . . -36.16 150.94 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.908 179.856 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.518 ' CB ' ' O ' ' A' ' 36' ' ' ARG . 1.4 tp -167.64 153.6 7.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.906 0.384 . . . . 0.0 111.275 -179.734 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.505 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.3 t -119.81 123.03 70.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.192 179.35 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.515 ' HB2' ' CE2' ' A' ' 34' ' ' TRP . 85.2 m -104.15 159.1 15.97 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.636 -179.141 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.473 ' O ' ' CE1' ' A' ' 48' ' ' TYR . 6.6 m -140.36 116.6 10.58 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.712 179.639 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.555 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 6.4 t -82.33 133.7 35.24 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.228 -179.569 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.473 ' CE1' ' O ' ' A' ' 46' ' ' THR . 7.1 m-85 -117.38 -27.08 6.49 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.629 179.864 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 138.67 174.14 13.31 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.902 -0.666 . . . . 0.0 112.227 -179.807 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -75.34 64.62 2.45 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.631 -0.795 . . . . 0.0 112.439 -179.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -173.02 -64.29 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.792 0.33 . . . . 0.0 111.003 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -67.39 -24.95 65.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.242 -179.773 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 70.97 134.79 0.11 Allowed Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.216 -179.746 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.57 ' CD1' ' O ' ' A' ' 54' ' ' PHE . 4.8 p90 -69.98 132.66 46.26 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.942 0.401 . . . . 0.0 111.304 -179.692 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -108.39 140.54 41.53 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.237 179.542 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.505 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 2.4 m -126.63 176.01 7.53 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.992 0.425 . . . . 0.0 111.491 -179.529 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 177.52 -171.57 0.1 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.73 -179.912 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -56.9 141.71 44.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.952 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -73.16 119.27 74.81 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.965 179.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_exo -46.58 145.42 6.35 Favored 'Trans proline' 0 N--CA 1.464 -0.221 0 C-N-CA 122.722 2.281 . . . . 0.0 112.3 179.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.28 -30.87 70.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.827 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.534 ' HA ' ' HB2' ' A' ' 97' ' ' ALA . . . -135.04 153.65 51.99 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.967 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -111.84 -56.35 2.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.573 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 171.49 176.4 0.07 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.999 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 17.5 p 60.86 -177.65 0.11 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.224 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 20.2 t 176.2 129.17 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.854 179.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.547 ' CE1' ' HA ' ' A' ' 69' ' ' LYS . 53.2 t80 -85.39 108.07 17.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.007 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . 0.464 ' O ' ' O ' ' A' ' 69' ' ' LYS . 1.2 t70 -81.34 85.75 6.37 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.737 179.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.547 ' HA ' ' CE1' ' A' ' 67' ' ' PHE . 0.3 OUTLIER -39.81 164.46 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.905 -179.941 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.503 ' CD1' ' N ' ' A' ' 70' ' ' TYR . 2.0 m-30 83.95 -46.31 0.11 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.892 -179.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -111.87 -42.04 3.88 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.131 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . 0.443 ' HA2' ' CE2' ' A' ' 67' ' ' PHE . . . 90.34 5.62 69.58 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.751 -0.738 . . . . 0.0 112.554 -179.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 65.9 m-80 -74.01 105.82 5.42 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.845 0.355 . . . . 0.0 110.906 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 26.5 m -54.43 118.03 3.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.013 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.486 ' CE2' ' HB3' ' A' ' 81' ' ' TYR . 17.2 m-30 -110.05 177.58 4.67 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.696 179.894 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.476 ' HB2' ' HB2' ' A' ' 79' ' ' ASP . 0.6 OUTLIER -104.37 141.62 36.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.871 179.969 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.463 ' HA ' ' O ' ' A' ' 94' ' ' CYS . 9.0 p -47.8 -29.43 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.138 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -105.8 14.39 45.57 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.499 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.476 ' HB2' ' HB2' ' A' ' 76' ' ' ARG . 8.9 t70 -112.23 110.92 21.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.896 0.379 . . . . 0.0 110.887 -179.913 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.509 HG22 ' OG1' ' A' ' 93' ' ' THR . 2.7 p -81.89 150.46 27.75 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.158 179.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.537 ' OH ' HG21 ' A' ' 102' ' ' ILE . 11.6 p90 -123.17 -33.08 3.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.946 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.469 ' HB3' ' O ' ' A' ' 81' ' ' TYR . 30.7 tt0 76.44 165.75 0.25 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.92 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.4 ' HA ' ' HD2' ' A' ' 84' ' ' PRO . 0.2 OUTLIER -172.39 107.57 0.35 Allowed Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.742 179.964 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.401 ' HA ' ' HA ' ' A' ' 89' ' ' ILE . 49.4 Cg_endo -68.94 89.6 0.44 Allowed 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.716 2.277 . . . . 0.0 112.352 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 10.3 mttt -111.54 137.06 49.87 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.919 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 68.24 9.01 6.96 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.004 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.0 p 69.97 13.19 7.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.947 179.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.417 ' HB3' ' NE1' ' A' ' 90' ' ' TRP . 0.0 OUTLIER -102.1 -23.32 14.08 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.96 -179.933 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.405 ' O ' ' O ' ' A' ' 88' ' ' MET . 2.9 mp 59.31 122.29 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.12 -179.891 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . 0.563 ' CH2' HD11 ' A' ' 106' ' ' ILE . 4.5 m95 -131.94 109.74 10.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.959 -179.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -57.77 79.79 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.663 179.82 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . 0.702 ' SG ' HG22 ' A' ' 102' ' ' ILE . 0.5 OUTLIER -82.65 152.51 25.83 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.069 -179.782 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.509 ' OG1' HG22 ' A' ' 80' ' ' THR . 25.9 m -125.71 126.73 45.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.974 179.841 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.608 ' HA ' HD12 ' A' ' 102' ' ' ILE . 0.3 OUTLIER -57.83 80.11 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.024 -179.896 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.488 HG13 ' O ' ' A' ' 93' ' ' THR . 0.9 OUTLIER -97.57 141.43 15.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.199 179.975 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.432 ' HA3' ' HA3' ' A' ' 100' ' ' GLY . . . 127.36 162.74 11.23 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.436 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.534 ' HB2' ' HA ' ' A' ' 62' ' ' ALA . . . -96.94 57.92 1.55 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.78 0.324 . . . . 0.0 111.101 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.48 ' O ' ' CB ' ' A' ' 99' ' ' ARG . . . 92.72 7.99 62.52 Favored Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.506 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.48 ' CB ' ' O ' ' A' ' 98' ' ' GLY . 0.0 OUTLIER 162.21 38.88 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.88 0.371 . . . . 0.0 110.836 -179.92 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 0.432 ' HA3' ' HA3' ' A' ' 96' ' ' GLY . . . -76.8 -86.96 0.37 Allowed Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.491 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.558 ' N ' ' CD ' ' A' ' 101' ' ' ARG . 0.0 OUTLIER -176.12 94.91 0.06 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.831 0.348 . . . . 0.0 110.996 179.875 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.702 HG22 ' SG ' ' A' ' 92' ' ' CYS . 2.4 mm -58.59 99.43 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.951 179.734 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.416 ' C ' ' SG ' ' A' ' 92' ' ' CYS . 1.4 t -73.06 125.51 27.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.128 -179.82 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.472 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 59.2 m -108.32 164.17 12.55 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.834 179.923 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 3.2 t -178.27 149.45 0.53 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.181 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.563 HD11 ' CH2' ' A' ' 90' ' ' TRP . 5.0 mt -82.41 137.79 20.5 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.078 179.843 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -158.18 150.47 22.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.133 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . 0.482 ' O ' ' CB ' ' A' ' 109' ' ' ARG . 8.7 t30 179.49 59.29 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.918 -179.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . 0.482 ' CB ' ' O ' ' A' ' 108' ' ' ASN . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.244 -0.884 . . . . 0.0 110.887 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 83.7 p . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.785 0.326 . . . . 0.0 111.149 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.34 67.67 7.59 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.943 -179.789 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.48 ' O ' HG13 ' A' ' 30' ' ' ILE . 35.1 Cg_exo -61.33 -158.13 0.02 OUTLIER 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.897 2.398 . . . . 0.0 112.33 -179.947 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.469 ' HA2' HG13 ' A' ' 30' ' ' ILE . . . -70.73 -148.78 0.5 Allowed Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.443 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 81.0 m -134.83 93.76 3.07 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.912 0.387 . . . . 0.0 110.956 -179.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -47.91 147.89 1.85 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.023 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.43 ' O ' ' CG ' ' A' ' 24' ' ' ASN . 14.2 t0 -178.3 131.85 0.14 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.767 179.977 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.43 ' CG ' ' O ' ' A' ' 23' ' ' ASP . 10.1 p30 51.04 22.92 1.34 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.989 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 88.64 -10.18 73.1 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.705 -0.76 . . . . 0.0 112.508 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.418 ' HB3' ' CZ ' ' A' ' 28' ' ' TYR . 0.1 OUTLIER -92.56 131.29 37.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.795 0.331 . . . . 0.0 110.835 179.963 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 14.7 t-160 -113.87 91.08 3.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.145 -179.704 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.469 ' O ' ' HA3' ' A' ' 20' ' ' GLY . 0.5 OUTLIER -79.76 176.9 9.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.802 179.837 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.529 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 0.0 OUTLIER -91.11 148.11 22.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.953 -179.946 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.692 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.7 mp -48.07 148.76 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.298 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 11.6 m-20 62.79 15.54 8.27 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.197 179.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.529 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 15.1 tt0 -98.14 150.36 21.55 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.804 0.335 . . . . 0.0 110.727 179.864 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.968 ' HG2' HG23 ' A' ' 46' ' ' THR . 8.8 mt-30 -110.21 156.17 21.02 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.086 -179.737 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . 0.584 ' CH2' ' O ' ' A' ' 46' ' ' THR . 48.6 p90 -162.56 -170.9 2.55 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.76 179.603 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -112.39 132.82 54.81 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.41 -179.581 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.521 ' O ' ' N ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -134.17 -174.1 3.45 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.22 179.548 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.444 ' HG1' ' C ' ' A' ' 41' ' ' ASN . 1.7 t -145.53 134.93 23.1 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.963 0.411 . . . . 0.0 111.312 179.942 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.462 ' CB ' HD22 ' A' ' 43' ' ' LEU . 1.6 t80 -128.95 122.75 30.85 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.597 179.696 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.443 ' CB ' ' O ' ' A' ' 38' ' ' TYR . 1.5 tp 78.85 8.71 1.96 Allowed 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.663 -179.595 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 89.12 41.59 5.82 Favored Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.995 -0.622 . . . . 0.0 112.754 179.854 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.444 ' C ' ' HG1' ' A' ' 37' ' ' THR . 65.2 m-80 -152.14 136.85 17.01 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.681 0.277 . . . . 0.0 111.069 179.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.43 ' C ' ' O ' ' A' ' 41' ' ' ASN . . . -37.08 152.25 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.341 -0.391 . . . . 0.0 110.643 179.659 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.521 ' N ' ' O ' ' A' ' 36' ' ' ARG . 2.6 tp -167.15 156.56 10.57 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.02 0.438 . . . . 0.0 111.535 -179.537 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.505 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 15.2 t -110.09 155.54 11.3 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.693 178.927 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.574 ' SG ' ' CD1' ' A' ' 54' ' ' PHE . 0.1 OUTLIER -161.22 174.02 14.22 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.112 0.482 . . . . 0.0 111.6 -179.502 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.968 HG23 ' HG2' ' A' ' 33' ' ' GLN . 0.2 OUTLIER -138.79 -167.58 2.24 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.68 -0.691 . . . . 0.0 110.746 179.878 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.523 ' H ' HG22 ' A' ' 46' ' ' THR . 46.4 t -134.82 140.45 45.86 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.94 0.4 . . . . 0.0 111.019 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -110.54 -36.94 5.62 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.776 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.478 ' O ' ' N ' ' A' ' 51' ' ' SER . . . 127.18 163.66 11.49 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.805 -0.712 . . . . 0.0 112.406 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . 0.42 ' C ' ' O ' ' A' ' 49' ' ' GLY . . . 36.1 29.86 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.693 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.478 ' N ' ' O ' ' A' ' 49' ' ' GLY . 0.1 OUTLIER 49.65 35.24 8.35 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.86 0.362 . . . . 0.0 111.006 179.935 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.46 ' HG3' ' O ' ' A' ' 49' ' ' GLY . 9.7 mtp85 -58.83 -51.91 67.97 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.723 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 156.83 89.75 0.07 OUTLIER Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.613 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.574 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 1.8 p90 -58.17 -172.03 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.836 0.35 . . . . 0.0 110.813 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -136.13 114.09 11.29 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.76 179.89 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.505 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 13.3 m -94.61 -178.64 4.61 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.01 -179.855 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.504 ' O ' HD11 ' A' ' 43' ' ' LEU . 0.1 OUTLIER -171.95 -92.29 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.023 -179.996 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.485 ' HA ' ' HA ' ' A' ' 43' ' ' LEU . 0.2 OUTLIER 175.81 -177.16 0.12 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.365 -0.38 . . . . 0.0 110.914 -179.91 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 1.3 mmmt -90.87 159.51 40.14 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.915 -179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -49.01 177.49 0.02 OUTLIER 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.807 2.338 . . . . 0.0 112.339 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -138.68 18.0 2.69 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.812 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -123.05 117.4 25.36 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.004 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -88.07 107.64 18.85 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.635 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.457 ' HG2' ' O ' ' A' ' 64' ' ' GLU . 17.4 tt0 -177.29 39.54 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.889 179.969 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.406 ' C ' ' SG ' ' A' ' 66' ' ' CYS . 7.1 p -146.7 -166.16 2.42 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.129 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.473 ' O ' ' HB3' ' A' ' 67' ' ' PHE . 0.0 OUTLIER -157.02 -63.66 0.1 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.888 -179.934 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.473 ' HB3' ' O ' ' A' ' 66' ' ' CYS . 24.3 t80 79.76 92.25 0.05 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.806 179.986 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . 0.89 ' OD1' HD13 ' A' ' 102' ' ' ILE . 0.6 OUTLIER -88.69 44.4 1.2 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.988 -179.96 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.606 ' HG3' ' CD1' ' A' ' 70' ' ' TYR . 2.2 ptmt 36.16 -144.52 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.728 179.836 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.606 ' CD1' ' HG3' ' A' ' 69' ' ' LYS . 9.4 m-30 79.95 -50.33 0.37 Allowed 'General case' 0 C--O 1.231 0.129 0 CA-C-O 120.722 0.296 . . . . 0.0 110.854 -179.687 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 5.3 t -171.37 -35.88 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.26 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 141.41 55.88 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.554 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 24.0 m-80 -104.44 49.53 0.81 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.738 0.304 . . . . 0.0 110.963 -179.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.435 HG23 ' O ' ' A' ' 74' ' ' THR . 4.5 t -43.0 128.19 4.3 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.128 179.96 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.489 ' CE2' ' CE2' ' A' ' 81' ' ' TYR . 52.3 m-85 -108.06 -179.93 4.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.941 179.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 2.8 tpp180 -112.65 132.15 55.31 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.829 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.997 HG21 ' HB2' ' A' ' 97' ' ' ALA . 11.7 p -54.18 -19.5 3.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.091 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -111.7 34.96 4.96 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.686 -0.769 . . . . 0.0 112.529 -179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -154.1 125.62 7.53 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.888 0.375 . . . . 0.0 111.022 179.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 58.8 p -78.5 168.24 20.08 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.04 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.506 ' CZ ' ' CB ' ' A' ' 92' ' ' CYS . 22.3 p90 -166.38 167.47 15.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.859 -179.891 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.414 ' HB3' ' HA ' ' A' ' 91' ' ' ASP . 0.0 OUTLIER -138.99 132.45 30.25 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.849 179.89 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.423 ' HD2' ' OH ' ' A' ' 75' ' ' TYR . 3.3 mtp180 -136.2 140.91 34.26 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.023 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 76.6 Cg_endo -77.78 124.32 6.81 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.853 2.369 . . . . 0.0 112.327 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.535 ' O ' ' CB ' ' A' ' 86' ' ' ASP . 12.4 tppt? -129.27 108.37 10.27 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.879 179.845 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.535 ' CB ' ' O ' ' A' ' 85' ' ' LYS . 6.7 t0 87.86 -35.18 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.03 -179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.5 ' CB ' ' O ' ' A' ' 86' ' ' ASP . 0.4 OUTLIER 159.02 -23.33 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.771 -179.999 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -98.32 154.84 17.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.875 -179.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 14.0 mt -106.05 135.0 46.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.072 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . 0.611 ' CD1' ' N ' ' A' ' 90' ' ' TRP . 0.1 OUTLIER -130.23 130.78 45.07 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.832 179.955 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.414 ' HA ' ' HB3' ' A' ' 82' ' ' GLU . 60.2 m-20 -72.58 62.41 0.55 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.942 -179.878 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . 0.506 ' CB ' ' CZ ' ' A' ' 81' ' ' TYR . 57.1 m -48.91 145.23 4.03 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.148 -0.478 . . . . 0.0 111.0 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.445 ' O ' ' N ' ' A' ' 95' ' ' ILE . 10.6 m -132.15 125.42 31.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.038 179.843 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 45.3 t -61.59 77.87 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.854 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.445 ' N ' ' O ' ' A' ' 93' ' ' THR . 1.5 mt -90.75 84.55 2.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.307 -179.84 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 157.1 -23.4 0.46 Allowed Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.455 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.997 ' HB2' HG21 ' A' ' 77' ' ' VAL . . . 59.56 44.09 15.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.855 0.36 . . . . 0.0 111.042 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 159.63 -55.69 0.34 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.528 -179.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 178.99 44.65 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.809 0.337 . . . . 0.0 110.973 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -74.61 -64.81 2.28 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.739 -0.743 . . . . 0.0 112.489 179.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.512 ' O ' ' N ' ' A' ' 103' ' ' SER . 1.5 ptt180 -177.7 62.79 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.725 0.298 . . . . 0.0 110.94 -179.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.89 HD13 ' OD1' ' A' ' 68' ' ' ASP . 13.2 mt -36.15 91.94 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.135 -179.93 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.512 ' N ' ' O ' ' A' ' 101' ' ' ARG . 0.3 OUTLIER -74.23 145.98 43.67 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.815 179.986 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 29.7 m -146.27 137.78 24.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.828 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 3.4 t -143.1 127.19 17.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.15 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.572 HG13 ' CE3' ' A' ' 90' ' ' TRP . 3.0 mt -41.6 126.01 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.033 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -107.49 105.78 15.85 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.07 179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . 0.503 ' O ' ' CB ' ' A' ' 109' ' ' ARG . 4.6 m-20 -69.02 82.1 0.31 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.904 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . 0.503 ' CB ' ' O ' ' A' ' 108' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.195 -0.907 . . . . 0.0 110.9 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.402 0 CA-C-O 120.841 0.353 . . . . 0.0 111.112 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.65 94.53 31.91 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.937 -179.907 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -81.48 123.72 4.45 Favored 'Trans proline' 0 N--CA 1.462 -0.356 0 C-N-CA 122.901 2.401 . . . . 0.0 112.419 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.454 ' HA2' HG13 ' A' ' 30' ' ' ILE . . . 126.86 -173.88 18.26 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.682 -0.771 . . . . 0.0 112.611 179.934 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 3.3 m -145.91 91.76 2.12 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.852 0.358 . . . . 0.0 110.779 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -57.3 129.59 42.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.003 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.455 ' OD2' ' CE2' ' A' ' 54' ' ' PHE . 0.4 OUTLIER -161.65 135.17 6.47 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.82 179.98 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.424 ' CG ' ' O ' ' A' ' 24' ' ' ASN . 36.3 t30 62.28 38.96 12.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.865 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 60.47 17.45 47.72 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.622 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.578 ' HB3' ' CE1' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -133.05 137.82 46.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.848 0.356 . . . . 0.0 110.949 -179.985 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 51.9 t-80 -105.38 96.87 6.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.834 179.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.578 ' CE1' ' HB3' ' A' ' 26' ' ' LYS . 10.4 m-30 -79.68 170.54 16.38 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.804 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.489 ' O ' ' HB2' ' A' ' 32' ' ' GLN . 4.8 tm0? -89.93 130.98 36.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.504 179.742 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.65 HD12 ' H ' ' A' ' 30' ' ' ILE . 4.3 mp -33.99 148.22 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.924 0.393 . . . . 0.0 111.383 -179.845 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.423 ' HB2' ' O ' ' A' ' 30' ' ' ILE . 34.1 m-20 76.47 4.53 3.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.847 -179.672 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.489 ' HB2' ' O ' ' A' ' 29' ' ' GLN . 7.2 tp60 -91.08 134.38 34.56 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.582 179.712 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.449 ' O ' ' NE2' ' A' ' 32' ' ' GLN . 20.9 mt-30 -103.17 148.31 25.93 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.034 -179.792 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . 0.551 ' CZ2' ' HB3' ' A' ' 45' ' ' CYS . 35.5 p90 -157.28 179.01 9.67 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.672 179.886 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.69 ' OE2' ' HB1' ' A' ' 42' ' ' ALA . 0.2 OUTLIER -118.54 122.16 42.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.904 0.383 . . . . 0.0 111.377 -179.551 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.9 ' O ' HD22 ' A' ' 43' ' ' LEU . 3.8 ttt85 -114.59 141.53 47.64 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.528 179.592 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.532 ' CG2' ' N ' ' A' ' 38' ' ' TYR . 1.4 m -102.03 162.35 12.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.037 -179.782 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.532 ' N ' ' CG2' ' A' ' 37' ' ' THR . 13.0 t80 177.02 115.26 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.079 -0.509 . . . . 0.0 110.754 179.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.513 ' O ' ' ND2' ' A' ' 41' ' ' ASN . 0.8 OUTLIER 74.66 34.43 0.74 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.831 -179.864 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 68.04 30.55 74.08 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.43 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.513 ' ND2' ' O ' ' A' ' 39' ' ' LEU . 22.6 m-80 -134.12 146.0 49.84 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 120.837 0.351 . . . . 0.0 110.962 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.892 ' C ' HD13 ' A' ' 43' ' ' LEU . . . -100.08 112.34 24.63 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.999 179.896 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.9 HD22 ' O ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -112.81 143.41 44.1 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.013 -179.989 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.497 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.7 t -93.7 126.9 46.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.348 179.261 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.57 ' SG ' ' CE1' ' A' ' 54' ' ' PHE . 6.2 m -105.64 166.94 10.1 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.698 -179.207 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.455 ' O ' ' HA ' ' A' ' 54' ' ' PHE . 26.0 m -150.49 124.47 9.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.679 179.642 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.485 ' SG ' ' HA ' ' A' ' 30' ' ' ILE . 15.1 t -79.79 130.39 35.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.032 -179.712 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -111.97 -25.59 9.31 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.93 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 94.58 -179.14 37.13 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.451 -179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 42.59 -129.69 5.0 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.59 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -89.33 -27.97 20.14 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.825 0.345 . . . . 0.0 110.979 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -49.69 -29.52 7.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.964 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 50.11 -125.37 19.95 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.629 179.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.57 ' CE1' ' SG ' ' A' ' 45' ' ' CYS . 1.1 p90 -132.85 160.2 37.64 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.829 0.347 . . . . 0.0 110.902 -179.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -138.23 85.47 2.1 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.713 179.79 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.497 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.1 OUTLIER -63.3 158.9 19.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.045 -179.741 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -137.65 -70.13 0.44 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.844 179.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.484 ' HA ' ' HA ' ' A' ' 43' ' ' LEU . 85.0 p -172.59 176.86 3.12 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.822 179.961 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 46.3 tptt -102.62 101.53 20.91 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.78 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.477 ' HD3' ' O ' ' A' ' 58' ' ' SER . 53.2 Cg_exo -52.15 104.26 0.09 OUTLIER 'Trans proline' 0 C--N 1.342 0.21 0 C-N-CA 122.697 2.265 . . . . 0.0 112.361 -179.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -38.26 -74.27 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.757 179.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -131.77 138.82 48.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.962 179.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.422 ' O ' ' N ' ' A' ' 65' ' ' THR . 1.3 tt0 -85.83 -47.12 10.0 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.43 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 87.9 mt-10 -62.33 78.59 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.806 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.422 ' N ' ' O ' ' A' ' 63' ' ' GLU . 7.3 p -142.45 150.67 40.88 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.189 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.422 ' SG ' ' HB2' ' A' ' 75' ' ' TYR . 0.3 OUTLIER -152.02 178.73 9.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.613 179.924 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 12.0 t80 -168.73 100.94 0.4 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.966 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . 0.477 ' O ' ' O ' ' A' ' 69' ' ' LYS . 28.2 t0 -101.97 32.52 3.41 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.855 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.504 ' HD2' ' CE1' ' A' ' 70' ' ' TYR . 0.0 OUTLIER 39.07 -165.76 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.153 179.808 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.504 ' CE1' ' HD2' ' A' ' 69' ' ' LYS . 12.4 m-85 74.56 -54.62 0.67 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.131 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -127.33 -4.25 6.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.295 -179.84 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 51.69 26.13 16.22 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.749 -0.739 . . . . 0.0 112.361 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . 0.541 ' O ' ' CE1' ' A' ' 75' ' ' TYR . 35.7 t-20 -77.04 90.88 3.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.739 0.305 . . . . 0.0 110.965 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 56.2 m -49.52 119.41 3.39 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.036 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.541 ' CE1' ' O ' ' A' ' 73' ' ' ASN . 9.9 m-85 -102.95 172.8 6.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.818 179.955 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -111.92 133.55 54.04 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.781 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.447 ' HA ' ' HB3' ' A' ' 94' ' ' CYS . 53.1 t -49.4 -37.15 10.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.06 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -85.14 41.67 3.08 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.641 -0.79 . . . . 0.0 112.498 179.869 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -164.32 178.32 7.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.83 0.348 . . . . 0.0 110.993 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 1.052 HG22 HG23 ' A' ' 93' ' ' THR . 19.1 p -132.7 151.28 52.01 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.059 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 24.0 p90 -136.72 115.19 11.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.876 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -82.18 112.99 19.7 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.798 179.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.2 106.0 53.47 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.921 -179.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.466 ' HB3' HG12 ' A' ' 89' ' ' ILE . 71.5 Cg_endo -74.66 141.27 27.51 Favored 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.816 2.344 . . . . 0.0 112.303 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.462 ' O ' ' CB ' ' A' ' 86' ' ' ASP . 12.3 tptp -151.51 99.15 2.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.948 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.462 ' CB ' ' O ' ' A' ' 85' ' ' LYS . 0.3 OUTLIER 80.31 -167.54 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.907 -179.969 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -81.65 55.97 2.85 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.87 -179.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 2.9 ptp -145.52 -60.97 0.34 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.881 -179.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.466 HG12 ' HB3' ' A' ' 84' ' ' PRO . 60.9 mt 62.45 130.47 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.179 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . 0.614 ' CD1' ' N ' ' A' ' 90' ' ' TRP . 0.0 OUTLIER -137.65 172.76 12.48 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.884 179.971 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -110.24 82.68 1.63 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.902 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 23.2 m -68.77 135.05 50.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.981 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 1.052 HG23 HG22 ' A' ' 80' ' ' THR . 0.8 OUTLIER -115.91 174.76 5.86 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.924 179.782 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.633 ' H ' HG22 ' A' ' 93' ' ' THR . 36.7 t -108.99 40.27 1.85 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.87 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 2.0 mt -56.76 110.68 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.38 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 140.74 135.86 3.25 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.738 -0.744 . . . . 0.0 112.497 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -60.97 -14.77 24.98 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.838 0.352 . . . . 0.0 111.113 179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.42 ' O ' ' HB3' ' A' ' 99' ' ' ARG . . . -144.08 24.98 2.07 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.726 -0.75 . . . . 0.0 112.535 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.624 ' HG2' HD11 ' A' ' 102' ' ' ILE . 4.5 tmm_? 64.8 132.22 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.843 0.354 . . . . 0.0 110.928 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 165.76 -36.04 0.26 Allowed Glycine 0 N--CA 1.452 -0.249 0 C-N-CA 120.705 -0.759 . . . . 0.0 112.42 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 3.1 mtm-85 -102.52 43.12 1.09 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.832 0.348 . . . . 0.0 110.846 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.673 ' H ' HD12 ' A' ' 102' ' ' ILE . 5.2 mp -54.41 95.47 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.142 -179.821 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.72 124.66 28.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.649 179.774 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.523 ' SG ' HG22 ' A' ' 102' ' ' ILE . 4.1 m -129.04 121.96 28.99 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.994 -179.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 1.1 t -135.83 139.88 43.79 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.985 179.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.541 ' O ' ' HB2' ' A' ' 107' ' ' ALA . 2.6 mt -61.1 143.05 15.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.101 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.541 ' HB2' ' O ' ' A' ' 106' ' ' ILE . . . 171.6 117.79 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.116 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -163.68 116.47 1.47 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.85 -179.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 18.3 ttp180 . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.267 -0.873 . . . . 0.0 110.9 179.912 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.35 0 CA-C-O 120.835 0.35 . . . . 0.0 111.201 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.514 ' CG ' ' O ' ' A' ' 18' ' ' LYS . 0.0 OUTLIER -150.62 65.73 7.19 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.966 179.978 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -57.62 169.74 2.27 Favored 'Trans proline' 0 C--O 1.231 0.147 0 C-N-CA 122.694 2.263 . . . . 0.0 112.265 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 114.43 167.6 15.89 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.648 -0.786 . . . . 0.0 112.536 179.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 8.9 p -152.59 123.34 7.38 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.793 0.33 . . . . 0.0 110.847 -180.0 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 7.0 t80 -92.08 95.4 9.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.924 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.446 ' OD2' ' CE1' ' A' ' 54' ' ' PHE . 1.2 m-20 -117.0 139.61 50.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.821 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.464 ' OD1' ' O ' ' A' ' 24' ' ' ASN . 27.5 t-20 50.09 45.59 25.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.709 -179.959 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 58.12 16.86 28.09 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.722 -0.751 . . . . 0.0 112.363 -179.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.95 152.56 47.74 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.818 0.342 . . . . 0.0 110.936 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 20.9 t-80 -116.85 97.97 6.25 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.136 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 15.6 m-85 -79.87 -178.72 6.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.854 179.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.495 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 2.1 tt0 -93.64 120.65 34.18 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.588 179.709 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.705 HD12 ' H ' ' A' ' 30' ' ' ILE . 4.4 mp -33.86 138.91 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.353 -179.825 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.488 ' N ' ' O ' ' A' ' 47' ' ' CYS . 34.3 m-20 76.97 5.35 3.31 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.762 -179.686 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.495 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 11.8 tt0 -86.61 154.19 21.22 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.774 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.965 ' CG ' HG23 ' A' ' 46' ' ' THR . 36.5 mt-30 -122.64 124.84 44.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.15 -179.683 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . 0.548 ' CZ3' ' HB2' ' A' ' 47' ' ' CYS . 22.9 p90 -131.0 175.63 8.92 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.791 179.742 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 33.6 tp10 -100.18 126.64 46.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.863 0.363 . . . . 0.0 111.313 -179.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.451 ' O ' ' O ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -138.25 -161.93 1.24 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.468 179.643 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.471 ' HG1' ' C ' ' A' ' 41' ' ' ASN . 2.2 t -143.83 141.46 30.37 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.952 0.406 . . . . 0.0 111.452 -179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.769 ' HB2' HD22 ' A' ' 43' ' ' LEU . 9.8 t80 -131.17 132.73 44.94 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.461 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 3.4 mp 63.44 16.96 9.97 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.947 0.404 . . . . 0.0 110.319 -179.53 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 83.41 37.07 12.74 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.938 -0.649 . . . . 0.0 112.563 -179.871 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.471 ' C ' ' HG1' ' A' ' 37' ' ' THR . 64.1 m-80 -146.55 139.7 25.58 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-O 120.77 0.319 . . . . 0.0 111.075 -179.9 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -48.04 134.19 14.13 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.835 179.739 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.845 HD12 ' O ' ' A' ' 57' ' ' GLU . 0.0 OUTLIER -165.36 147.44 7.67 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.02 0.438 . . . . 0.0 110.954 -179.752 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.465 ' O ' ' HB3' ' A' ' 56' ' ' CYS . 5.1 t -90.11 134.46 29.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.809 179.822 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.488 ' HA ' ' HA ' ' A' ' 56' ' ' CYS . 5.4 m -119.65 123.4 43.77 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.107 -179.706 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.965 HG23 ' CG ' ' A' ' 33' ' ' GLN . 0.2 OUTLIER -94.77 -174.04 3.17 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.003 179.868 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.659 ' H ' HG22 ' A' ' 46' ' ' THR . 27.8 t -138.69 119.8 14.55 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.85 0.357 . . . . 0.0 110.88 -179.843 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 9.9 m-30 -90.91 -46.32 8.25 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.261 -179.871 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 103.14 166.33 25.81 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.75 -0.738 . . . . 0.0 112.45 -179.737 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 65.31 -116.83 9.23 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.612 179.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 4.9 p -125.11 -6.85 7.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.731 0.301 . . . . 0.0 111.187 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 4.0 mtm180 -56.91 -29.28 62.91 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.897 0.379 . . . . 0.0 110.876 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 64.33 137.2 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.86 -0.686 . . . . 0.0 112.729 179.828 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.528 ' CB ' ' O ' ' A' ' 46' ' ' THR . 38.5 p90 -59.28 -167.8 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.574 0.226 . . . . 0.0 110.671 179.737 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.524 ' O ' ' CB ' ' A' ' 56' ' ' CYS . 2.3 t30 -147.16 -49.95 0.19 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.821 0.343 . . . . 0.0 111.601 -179.739 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.524 ' CB ' ' O ' ' A' ' 55' ' ' ASN . 5.2 m 85.62 -172.64 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.424 -179.611 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.845 ' O ' HD12 ' A' ' 43' ' ' LEU . 3.9 tt0 -156.78 -89.23 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.858 0.361 . . . . 0.0 111.359 -179.837 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.468 ' HA ' ' HA ' ' A' ' 43' ' ' LEU . 0.3 OUTLIER 170.97 146.44 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.835 -179.701 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.445 ' HA ' ' HD2' ' A' ' 60' ' ' PRO . 0.0 OUTLIER -39.83 116.3 1.15 Allowed Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.813 179.941 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.445 ' HD2' ' HA ' ' A' ' 59' ' ' LYS . 19.6 Cg_endo -60.89 -177.89 0.2 Allowed 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.702 2.268 . . . . 0.0 112.311 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -110.14 -63.37 1.39 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.976 -179.848 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -159.15 168.32 26.89 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.201 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.407 ' HG3' HG11 ' A' ' 77' ' ' VAL . 0.1 OUTLIER -115.46 123.19 47.94 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.55 -179.989 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -163.86 139.4 6.31 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.84 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.503 ' OG1' ' CG2' ' A' ' 74' ' ' THR . 12.6 p -57.95 -176.63 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.273 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 60.1 m -114.46 156.43 24.56 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.944 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 89.8 t80 -112.35 87.6 2.61 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.972 179.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.95 85.96 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.937 179.946 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 4.2 ptmt -41.08 -28.2 0.08 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.869 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 14.6 m-30 -40.02 -72.74 0.06 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.924 179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.516 HG22 ' O ' ' A' ' 71' ' ' THR . 6.3 m -117.78 20.79 13.25 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.099 179.817 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 55.95 54.23 36.74 Favored Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.46 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . 0.434 ' OD1' ' HB ' ' A' ' 71' ' ' THR . 0.4 OUTLIER -108.41 -162.9 0.84 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.763 0.316 . . . . 0.0 110.846 179.949 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.503 ' CG2' ' OG1' ' A' ' 65' ' ' THR . 1.1 m -146.01 133.05 20.3 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.065 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.443 ' O ' ' HB ' ' A' ' 65' ' ' THR . 2.7 m-85 -123.22 128.64 50.29 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.859 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 2.7 mmt180 -45.55 137.5 5.04 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.849 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.42 ' HA ' ' SG ' ' A' ' 94' ' ' CYS . 12.2 p -82.09 -17.03 11.72 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.194 -179.912 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -102.04 9.38 56.45 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.713 -0.756 . . . . 0.0 112.446 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -138.52 159.26 42.53 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.828 0.347 . . . . 0.0 110.896 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.497 ' OG1' ' N ' ' A' ' 81' ' ' TYR . 0.1 OUTLIER -106.59 -173.4 2.29 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.989 179.943 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.532 ' CZ ' ' HB3' ' A' ' 92' ' ' CYS . 15.2 p90 -164.74 -177.81 4.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.868 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -135.2 110.54 9.03 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.82 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.61 96.05 9.7 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.904 -179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -69.78 84.37 0.66 Allowed 'Trans proline' 0 C--O 1.231 0.145 0 C-N-CA 122.78 2.32 . . . . 0.0 112.227 -179.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.87 139.37 32.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.91 179.887 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 46.32 -157.89 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.935 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.432 ' O ' ' HB2' ' A' ' 88' ' ' MET . 0.4 OUTLIER -84.03 62.8 7.25 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.931 -179.986 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.432 ' HB2' ' O ' ' A' ' 87' ' ' SER . 1.3 ttt 174.44 149.6 0.08 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.926 -179.944 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.534 ' C ' ' CD1' ' A' ' 90' ' ' TRP . 17.1 mt -110.37 157.79 10.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.124 179.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . 0.778 ' CZ3' HD11 ' A' ' 106' ' ' ILE . 0.1 OUTLIER -146.0 134.08 21.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.948 179.989 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 29.2 t0 -72.41 62.8 0.53 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.774 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . 0.532 ' HB3' ' CZ ' ' A' ' 81' ' ' TYR . 67.9 m -55.49 146.04 21.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.052 -179.87 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.477 ' O ' ' N ' ' A' ' 95' ' ' ILE . 21.2 m -144.03 141.31 30.04 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.96 179.806 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.42 ' SG ' ' HA ' ' A' ' 77' ' ' VAL . 50.3 t -66.29 60.21 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.975 -179.759 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.603 HD12 ' CB ' ' A' ' 103' ' ' SER . 2.6 mt -68.77 80.17 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.001 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -114.34 -107.15 2.71 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.67 -0.776 . . . . 0.0 112.462 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . 55.09 79.79 0.14 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.748 0.309 . . . . 0.0 111.085 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 82.65 -55.28 4.99 Favored Glycine 0 N--CA 1.453 -0.207 0 C-N-CA 120.693 -0.765 . . . . 0.0 112.448 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 6.8 mtt180 -179.12 63.23 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.889 0.376 . . . . 0.0 110.965 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 0.459 ' O ' ' HB3' ' A' ' 101' ' ' ARG . . . -89.28 -28.21 20.73 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.528 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.517 ' N ' ' O ' ' A' ' 95' ' ' ILE . 0.0 OUTLIER 66.8 104.24 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.81 0.338 . . . . 0.0 110.9 179.952 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.476 HG21 ' OH ' ' A' ' 81' ' ' TYR . 2.5 mp -36.32 128.36 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.126 179.81 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.603 ' CB ' HD12 ' A' ' 95' ' ' ILE . 29.2 t -110.21 163.08 13.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.077 -179.911 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 82.3 m -154.49 119.9 5.09 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.935 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 22.1 m -133.45 124.7 27.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.167 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.778 HD11 ' CZ3' ' A' ' 90' ' ' TRP . 2.4 mp -58.79 87.67 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.116 179.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -108.28 141.95 39.3 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.197 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -79.74 134.15 36.37 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.935 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.814 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 44.3 m . . . . . 0 N--CA 1.486 1.346 0 CA-C-O 120.825 0.345 . . . . 0.0 111.214 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 60.3 83.51 0.21 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.907 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.466 ' C ' HD11 ' A' ' 30' ' ' ILE . 94.7 Cg_endo -79.0 84.34 2.07 Favored 'Trans proline' 0 N--CA 1.463 -0.297 0 C-N-CA 122.853 2.369 . . . . 0.0 112.386 179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 176.81 -161.66 29.63 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.515 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.576 ' O ' ' CD2' ' A' ' 27' ' ' HIS . 0.1 OUTLIER -159.15 178.38 10.08 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.779 0.323 . . . . 0.0 110.878 -179.946 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 48.2 t80 -161.89 126.67 3.38 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.945 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -163.83 159.21 20.9 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.931 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 46.19 31.96 1.34 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.914 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 65.83 21.31 69.27 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.56 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.26 152.32 44.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.831 0.348 . . . . 0.0 110.91 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . 0.576 ' CD2' ' O ' ' A' ' 21' ' ' CYS . 6.0 t-160 -117.29 96.47 5.44 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.136 -179.689 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -88.53 -162.45 0.85 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.9 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.524 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 0.5 OUTLIER -124.83 156.7 37.4 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.756 179.868 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.679 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.5 mp -51.99 150.46 1.04 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.37 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.125 179.957 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 17.5 m-20 64.87 13.93 8.88 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.776 -179.871 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.524 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 12.9 tt0 -98.54 145.53 26.71 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.792 -179.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.727 ' HG2' HG23 ' A' ' 46' ' ' THR . 14.1 mt-30 -118.01 143.69 46.19 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.848 -179.78 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . 0.598 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 35.9 p90 -144.13 -172.07 3.69 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.829 179.83 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -116.08 133.14 56.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.928 0.394 . . . . 0.0 111.239 -179.814 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.4 171.24 14.77 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.502 179.72 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -134.69 142.8 46.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.937 0.398 . . . . 0.0 110.787 -179.841 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.502 ' CB ' HD22 ' A' ' 43' ' ' LEU . 0.7 OUTLIER -155.21 120.46 4.93 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.686 179.671 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.517 HD12 ' HA ' ' A' ' 39' ' ' LEU . 1.6 tp 80.91 22.62 0.36 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.58 -179.732 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 68.19 37.71 87.11 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.918 -0.658 . . . . 0.0 112.438 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.434 ' O ' ' C ' ' A' ' 42' ' ' ALA . 51.1 m-80 -148.35 133.37 18.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.667 0.27 . . . . 0.0 110.945 179.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.434 ' C ' ' O ' ' A' ' 41' ' ' ASN . . . -35.69 153.92 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.801 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.502 HD22 ' CB ' ' A' ' 38' ' ' TYR . 3.1 tp -161.52 146.05 13.2 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.144 -179.543 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.493 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 3.9 t -121.61 136.85 57.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.417 179.547 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.598 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 0.7 OUTLIER -116.41 161.39 19.14 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.322 -179.509 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.727 HG23 ' HG2' ' A' ' 33' ' ' GLN . 1.4 m -144.29 127.73 16.93 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.936 179.818 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.525 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 19.4 t -87.28 138.61 31.34 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.057 -179.868 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.554 ' C ' HG23 ' A' ' 30' ' ' ILE . 11.6 m-85 -122.4 -33.13 3.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.928 179.953 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.42 ' O ' ' HB2' ' A' ' 52' ' ' ARG . . . 64.75 -165.7 32.82 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.778 -0.725 . . . . 0.0 112.498 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . 0.501 ' O ' ' CB ' ' A' ' 51' ' ' SER . . . 56.65 31.13 60.19 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.687 -0.768 . . . . 0.0 112.523 -179.941 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.501 ' CB ' ' O ' ' A' ' 50' ' ' GLY . 0.8 OUTLIER 83.88 -10.01 0.95 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.706 0.289 . . . . 0.0 110.995 -179.978 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.42 ' HB2' ' O ' ' A' ' 49' ' ' GLY . 34.1 mtt85 -67.85 -46.78 70.8 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.021 -179.902 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 92.47 -141.33 15.53 Favored Glycine 0 N--CA 1.446 -0.638 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.608 -179.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.568 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 5.8 p90 -143.27 157.0 44.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.844 0.354 . . . . 0.0 110.92 -179.947 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 -131.57 124.89 30.97 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.809 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.493 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.5 OUTLIER -100.5 163.15 12.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.021 -179.963 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.466 ' O ' ' HA ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -175.02 -177.62 1.1 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.937 179.898 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -65.95 178.58 1.07 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.932 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.47 ' HD2' ' HD2' ' A' ' 60' ' ' PRO . 0.8 OUTLIER -78.17 157.37 78.4 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.891 179.992 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.47 ' HD2' ' HD2' ' A' ' 59' ' ' LYS . 74.7 Cg_exo -49.08 -65.99 0.15 Allowed 'Trans proline' 0 N--CA 1.465 -0.169 0 C-N-CA 122.826 2.35 . . . . 0.0 112.37 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.466 ' CB ' ' O ' ' A' ' 60' ' ' PRO . 24.2 tp10 162.44 -41.46 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.815 -179.957 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -89.22 121.97 32.04 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.072 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.406 ' O ' ' HB1' ' A' ' 97' ' ' ALA . 2.7 tt0 -57.4 -15.93 7.91 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-N 116.088 -0.506 . . . . 0.0 111.165 179.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.704 ' O ' HG23 ' A' ' 65' ' ' THR . 3.1 mt-10 -64.2 120.85 12.9 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.91 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.704 HG23 ' O ' ' A' ' 64' ' ' GLU . 0.2 OUTLIER 175.59 -171.82 0.07 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.116 179.952 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.834 ' O ' HG23 ' A' ' 74' ' ' THR . 4.1 t -178.27 169.17 1.87 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.923 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.413 ' O ' ' HB3' ' A' ' 68' ' ' ASP . 49.2 t80 -119.59 -52.95 2.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.959 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . 0.414 ' HB3' ' O ' ' A' ' 73' ' ' ASN . 17.6 t70 71.8 84.04 0.13 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.876 179.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.495 ' O ' ' CB ' ' A' ' 70' ' ' TYR . 0.0 OUTLIER -57.53 -170.61 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.903 179.914 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.709 ' C ' HG22 ' A' ' 71' ' ' THR . 7.3 m-85 84.4 -4.2 1.03 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.05 -179.882 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.709 HG22 ' C ' ' A' ' 70' ' ' TYR . 0.0 OUTLIER 165.26 -26.22 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.2 -179.95 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 97.64 76.18 1.27 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.709 -0.758 . . . . 0.0 112.478 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . 0.414 ' O ' ' HB3' ' A' ' 68' ' ' ASP . 2.6 m-20 -122.09 80.16 1.67 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.749 0.309 . . . . 0.0 110.96 179.954 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.834 HG23 ' O ' ' A' ' 66' ' ' CYS . 94.4 m -50.58 110.35 0.4 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.977 179.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.459 ' HB2' ' SG ' ' A' ' 94' ' ' CYS . 18.1 m-85 -108.68 164.08 12.69 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.646 -179.982 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 4.2 mtt180 -78.83 117.37 19.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.952 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.46 ' HA ' ' O ' ' A' ' 94' ' ' CYS . 7.6 p -47.83 -22.69 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.191 -179.922 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -95.06 11.54 69.29 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.517 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -144.79 151.12 38.34 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.814 0.34 . . . . 0.0 110.962 179.961 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.982 HG22 HG23 ' A' ' 93' ' ' THR . 0.6 OUTLIER -96.72 -155.41 0.48 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.14 -179.921 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.532 ' O ' ' CB ' ' A' ' 82' ' ' GLU . 9.6 p90 -172.02 -35.13 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.069 -179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.532 ' CB ' ' O ' ' A' ' 81' ' ' TYR . 0.7 OUTLIER 87.29 157.6 0.07 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.897 179.9 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 2.7 mtt-85 178.44 119.01 0.19 Allowed Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.849 179.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.73 167.62 25.17 Favored 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.748 2.299 . . . . 0.0 112.477 -179.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.436 ' O ' ' N ' ' A' ' 87' ' ' SER . 0.0 OUTLIER -171.8 150.46 2.65 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.649 179.976 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 56.8 -85.04 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.886 -179.857 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.436 ' N ' ' O ' ' A' ' 85' ' ' LYS . 0.4 OUTLIER -159.71 23.18 0.18 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.952 179.848 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.409 ' O ' ' CD1' ' A' ' 90' ' ' TRP . 0.0 OUTLIER -148.85 146.1 27.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.971 -179.854 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 10.4 mt -90.83 134.44 29.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.986 179.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . 0.559 ' CH2' HD11 ' A' ' 106' ' ' ILE . 1.0 OUTLIER -125.44 144.55 50.47 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.038 -179.901 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 57.9 m-20 -80.04 67.68 5.93 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.658 179.748 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . . . . . . . . . 23.1 m -55.09 124.62 17.46 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.035 -179.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.982 HG23 HG22 ' A' ' 80' ' ' THR . 2.0 m -117.87 113.96 22.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.977 179.819 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.555 ' HA ' HD12 ' A' ' 102' ' ' ILE . 0.0 OUTLIER -54.41 87.62 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.878 -179.81 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.467 HG13 ' O ' ' A' ' 93' ' ' THR . 2.3 mt -117.2 95.52 3.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.196 -179.925 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.414 ' HA3' ' HA2' ' A' ' 100' ' ' GLY . . . -145.98 -94.39 0.16 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.616 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.406 ' HB1' ' O ' ' A' ' 63' ' ' GLU . . . 62.68 41.18 9.47 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.846 0.355 . . . . 0.0 111.06 -179.867 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 139.21 -27.32 2.65 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.774 -0.727 . . . . 0.0 112.554 -179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.61 -31.71 3.95 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.841 0.353 . . . . 0.0 110.912 -179.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 0.414 ' HA2' ' HA3' ' A' ' 96' ' ' GLY . . . 60.36 50.71 64.65 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.548 -179.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 6.0 ptp180 -99.18 54.83 0.98 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.787 0.327 . . . . 0.0 110.928 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.555 HD12 ' HA ' ' A' ' 94' ' ' CYS . 5.4 mm -37.3 126.71 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.244 -179.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 5.9 t -99.14 131.06 45.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.888 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . . . . . . . . . 24.3 m -135.4 117.45 15.36 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.031 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 7.3 t -130.86 161.25 32.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.123 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.559 HD11 ' CH2' ' A' ' 90' ' ' TRP . 3.2 mp -82.89 121.21 35.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.091 179.911 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -49.68 140.73 10.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.149 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 65.0 t-20 -88.76 -34.85 16.97 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.869 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . 0.446 ' OXT' ' HG3' ' A' ' 109' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.947 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 5.0 m . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.809 0.337 . . . . 0.0 111.12 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.413 ' O ' ' O ' ' A' ' 19' ' ' PRO . 0.6 OUTLIER -113.77 153.9 45.89 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.116 -179.952 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.413 ' O ' ' O ' ' A' ' 18' ' ' LYS . 73.4 Cg_exo -48.46 -176.07 0.0 OUTLIER 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 122.792 2.328 . . . . 0.0 112.3 179.901 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 96.66 -156.51 21.08 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.588 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 59.7 m -147.99 97.39 2.79 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.857 0.361 . . . . 0.0 110.847 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 2.7 t80 -64.97 150.03 48.72 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.826 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.466 ' OD1' ' O ' ' A' ' 26' ' ' LYS . 4.7 p-10 -133.86 -159.99 1.01 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.14 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.421 ' C ' ' O ' ' A' ' 23' ' ' ASP . 1.5 m-20 -34.45 -42.99 0.15 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.941 -0.572 . . . . 0.0 111.171 -179.816 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -173.15 32.11 0.11 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.598 -0.81 . . . . 0.0 112.611 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.592 ' HB3' ' CZ ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -139.93 134.92 32.26 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.815 0.34 . . . . 0.0 110.843 179.964 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 5.8 t-160 -114.21 86.77 2.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.892 -179.67 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.592 ' CZ ' ' HB3' ' A' ' 26' ' ' LYS . 1.6 m-85 -79.62 -168.96 1.74 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.0 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -105.92 165.53 11.13 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.792 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.702 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.1 mp -58.68 150.35 5.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.473 -179.772 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 67.5 m-80 61.04 13.34 4.56 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.118 179.785 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.405 ' O ' ' CZ3' ' A' ' 34' ' ' TRP . 12.4 tt0 -91.3 150.0 21.5 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.679 179.813 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.454 ' HG2' HG23 ' A' ' 46' ' ' THR . 11.8 mt-30 -114.41 145.02 42.37 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.137 -179.73 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . 0.585 ' CZ2' ' HB3' ' A' ' 45' ' ' CYS . 44.1 p90 -151.59 175.71 12.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.677 179.656 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -111.24 119.8 40.12 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.957 0.408 . . . . 0.0 111.455 -179.563 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.474 ' N ' ' O ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -110.7 -179.84 3.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.369 179.466 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.459 ' CG2' ' N ' ' A' ' 38' ' ' TYR . 1.0 OUTLIER -135.73 159.78 40.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.992 0.425 . . . . 0.0 110.975 -179.669 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.526 ' HB2' HD22 ' A' ' 43' ' ' LEU . 2.3 t80 -178.42 137.06 0.16 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.54 179.933 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.48 ' HA ' HD12 ' A' ' 39' ' ' LEU . 0.4 OUTLIER 59.04 27.55 16.52 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.613 -179.746 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 67.37 49.82 48.88 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.889 -0.672 . . . . 0.0 112.666 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 68.1 m-80 -152.52 167.14 29.79 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.818 0.342 . . . . 0.0 111.016 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.735 ' O ' HD12 ' A' ' 43' ' ' LEU . . . -86.54 131.46 34.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.75 179.693 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.735 HD12 ' O ' ' A' ' 42' ' ' ALA . 8.5 mp -127.85 155.45 44.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.319 -179.658 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.484 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 1.9 t -120.58 121.64 65.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.426 179.466 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.585 ' HB3' ' CZ2' ' A' ' 34' ' ' TRP . 1.3 m -106.99 163.29 13.1 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.281 -179.516 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.454 HG23 ' HG2' ' A' ' 33' ' ' GLN . 2.9 m -149.25 117.52 6.44 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.832 179.782 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.468 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 21.1 t -73.97 134.49 43.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.072 -179.811 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.542 ' CB ' ' HB3' ' A' ' 52' ' ' ARG . 6.8 m-85 -107.24 -29.7 9.17 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.863 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 100.27 168.0 29.07 Favored Glycine 0 N--CA 1.452 -0.264 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.451 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 48.99 -123.27 10.6 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.38 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -105.15 -4.53 21.7 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.764 0.316 . . . . 0.0 110.998 179.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.542 ' HB3' ' CB ' ' A' ' 48' ' ' TYR . 2.2 mtt85 -47.9 -28.16 2.51 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.905 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 60.13 146.7 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.592 179.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.564 ' CD1' ' SG ' ' A' ' 45' ' ' CYS . 22.9 p90 -74.96 177.7 6.13 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.732 0.301 . . . . 0.0 110.941 179.937 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -154.85 118.67 4.6 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.958 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.484 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.8 OUTLIER -103.08 150.74 23.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.874 179.942 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.445 ' O ' ' HG ' ' A' ' 43' ' ' LEU . 0.3 OUTLIER -136.01 -86.08 0.35 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.906 -179.958 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.431 ' HA ' ' HA ' ' A' ' 43' ' ' LEU . 5.2 p -170.01 -166.05 0.53 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.96 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.437 ' HD2' ' C ' ' A' ' 59' ' ' LYS . 0.0 OUTLIER -146.45 93.85 4.91 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.878 -179.943 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -49.85 99.58 0.04 OUTLIER 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.782 2.321 . . . . 0.0 112.259 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -40.16 -29.62 0.08 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.064 -179.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -120.59 122.49 40.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.255 -179.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.567 ' O ' HG22 ' A' ' 65' ' ' THR . 1.8 tt0 -119.89 130.76 54.99 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.505 179.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.439 ' C ' HG22 ' A' ' 65' ' ' THR . 5.4 tt0 54.07 58.36 5.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.829 -180.0 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.567 HG22 ' O ' ' A' ' 63' ' ' GLU . 0.2 OUTLIER -160.81 -176.44 5.53 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.007 -179.998 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.495 ' N ' ' OG1' ' A' ' 65' ' ' THR . 0.6 OUTLIER -171.72 175.8 3.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.924 179.913 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.467 ' CE1' ' HA ' ' A' ' 69' ' ' LYS . 20.0 t80 -165.21 110.13 0.9 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.833 -179.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . 0.559 ' O ' ' CD2' ' A' ' 70' ' ' TYR . 44.4 t0 -108.45 38.5 2.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.883 -179.947 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.584 ' HG3' ' CD1' ' A' ' 70' ' ' TYR . 4.3 ptmt 34.22 -154.13 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.078 179.988 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.584 ' CD1' ' HG3' ' A' ' 69' ' ' LYS . 15.5 m-85 75.29 -54.22 0.65 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.949 179.978 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -138.47 -62.43 0.57 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.244 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 132.53 44.9 0.14 Allowed Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 120.574 -0.822 . . . . 0.0 112.572 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -88.95 74.06 8.24 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.795 0.331 . . . . 0.0 111.011 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 33.7 m -45.87 107.88 0.11 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.927 0.394 . . . . 0.0 111.029 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 -85.47 -157.98 0.35 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.884 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.433 ' HB2' ' HB2' ' A' ' 79' ' ' ASP . 16.2 mtm180 -143.53 135.62 26.77 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.779 179.857 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 52.9 t -43.9 -28.06 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.055 -179.789 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -109.53 31.03 7.91 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.424 179.813 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.433 ' HB2' ' HB2' ' A' ' 76' ' ' ARG . 0.6 OUTLIER -128.47 106.21 8.83 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.845 0.355 . . . . 0.0 110.829 179.998 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.618 HG23 HG23 ' A' ' 93' ' ' THR . 0.0 OUTLIER -85.94 118.96 25.74 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.144 -179.974 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.489 ' CZ ' ' HB3' ' A' ' 92' ' ' CYS . 30.1 p90 -120.06 173.87 6.83 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.753 179.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.446 ' HA ' ' O ' ' A' ' 90' ' ' TRP . 19.4 pt-20 -140.13 155.92 46.77 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.754 179.912 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.441 ' CZ ' ' HE2' ' A' ' 85' ' ' LYS . 0.0 OUTLIER -136.42 119.11 11.93 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.86 -179.929 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.66 95.09 0.62 Allowed 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.622 2.214 . . . . 0.0 112.242 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.441 ' HE2' ' CZ ' ' A' ' 83' ' ' ARG . 0.4 OUTLIER -146.81 163.76 34.99 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.905 -179.952 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 7.4 t0 56.21 49.51 15.23 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.832 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 9.3 m 43.54 31.17 0.4 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.923 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -159.18 175.56 13.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.892 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.458 ' O ' ' HA ' ' A' ' 106' ' ' ILE . 1.6 mp -126.27 134.17 67.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.158 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . 0.618 ' CD1' ' N ' ' A' ' 90' ' ' TRP . 0.0 OUTLIER -130.08 124.93 33.96 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.837 179.956 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.408 ' C ' ' O ' ' A' ' 81' ' ' TYR . 0.3 OUTLIER -78.93 71.14 5.37 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.993 -179.89 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . 0.489 ' HB3' ' CZ ' ' A' ' 81' ' ' TYR . 0.5 OUTLIER -45.97 136.42 6.54 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.895 179.808 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.618 HG23 HG23 ' A' ' 80' ' ' THR . 7.2 m -115.34 122.21 45.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.164 -179.906 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.452 ' SG ' ' O ' ' A' ' 96' ' ' GLY . 28.5 t -67.62 69.84 0.11 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.718 179.951 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -70.3 -7.88 9.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.408 -179.753 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.477 ' HA3' ' HA3' ' A' ' 100' ' ' GLY . . . -132.15 -165.6 11.35 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.55 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.419 ' HA ' ' O ' ' A' ' 65' ' ' THR . . . -140.3 -41.29 0.42 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.919 0.39 . . . . 0.0 110.927 179.912 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -152.88 17.42 0.73 Allowed Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.322 179.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 170.8 36.97 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.784 0.325 . . . . 0.0 110.957 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 0.477 ' HA3' ' HA3' ' A' ' 96' ' ' GLY . . . -97.8 -97.18 1.98 Allowed Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.688 -0.768 . . . . 0.0 112.563 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.496 ' O ' ' CG ' ' A' ' 101' ' ' ARG . 0.0 OUTLIER 170.55 75.17 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.792 0.33 . . . . 0.0 110.921 179.924 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 18.8 mt -58.14 79.55 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.085 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.481 ' N ' ' O ' ' A' ' 101' ' ' ARG . 9.6 t -58.65 167.82 1.38 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.033 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.415 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 0.0 OUTLIER -146.8 104.95 3.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.774 179.937 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 2.8 t -118.55 135.31 54.48 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.117 -179.896 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.48 ' HA ' ' HA ' ' A' ' 90' ' ' TRP . 2.4 mp -60.2 142.3 15.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.914 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -132.95 107.31 8.21 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.052 179.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . 0.417 ' O ' ' C ' ' A' ' 109' ' ' ARG . 32.0 t-20 -112.13 129.81 56.11 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.998 -179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . 0.417 ' C ' ' O ' ' A' ' 108' ' ' ASN . 1.0 OUTLIER . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.155 -0.926 . . . . 0.0 110.852 179.959 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 53.9 p . . . . . 0 N--CA 1.485 1.324 0 CA-C-O 120.829 0.347 . . . . 0.0 111.096 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -116.21 134.78 22.76 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.948 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -76.94 170.63 19.45 Favored 'Trans proline' 0 N--CA 1.464 -0.253 0 C-N-CA 122.738 2.292 . . . . 0.0 112.418 -179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 126.89 171.88 13.17 Favored Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.762 -0.733 . . . . 0.0 112.512 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 50.6 m -112.19 85.66 2.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.781 0.325 . . . . 0.0 110.793 -179.981 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -74.78 124.05 26.1 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.0 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.425 ' O ' ' CG ' ' A' ' 24' ' ' ASN . 0.3 OUTLIER -167.91 147.6 4.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.889 179.897 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.429 ' ND2' ' HB2' ' A' ' 26' ' ' LYS . 8.0 p-10 46.02 53.41 9.16 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.934 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 53.92 20.27 13.22 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.541 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.589 ' HB3' ' CZ ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -125.83 133.74 51.88 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.807 0.337 . . . . 0.0 111.004 -179.996 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 4.0 t-160 -117.97 84.18 2.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.956 -179.915 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.589 ' CZ ' ' HB3' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -79.91 167.88 19.95 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.79 179.906 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.483 ' O ' ' HB2' ' A' ' 32' ' ' GLN . 8.5 mt-30 -93.12 170.7 9.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.786 179.808 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.719 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.0 mp -65.49 153.74 8.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.338 -179.909 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 84.6 m-20 55.01 17.69 1.97 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.089 179.8 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.483 ' HB2' ' O ' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -97.1 139.26 33.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.816 179.809 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 11.7 mt-30 -107.01 148.66 28.43 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.872 -179.801 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . 0.534 ' CE2' ' CE1' ' A' ' 28' ' ' TYR . 38.8 p90 -165.75 -167.41 1.1 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.902 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.404 ' OE2' ' HE2' ' A' ' 59' ' ' LYS . 8.5 mt-10 -119.18 125.25 48.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.067 -179.786 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.481 ' O ' HD22 ' A' ' 43' ' ' LEU . 0.4 OUTLIER -121.6 123.39 41.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.55 179.714 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.483 ' HA ' ' O ' ' A' ' 41' ' ' ASN . 1.3 m -99.89 136.27 40.05 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.828 -179.565 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.812 ' CE1' HD13 ' A' ' 39' ' ' LEU . 5.8 t80 -152.04 142.76 22.86 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.707 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.812 HD13 ' CE1' ' A' ' 38' ' ' TYR . 0.0 OUTLIER 53.37 41.4 32.12 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.674 -179.761 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 60.3 50.56 66.3 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.521 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.483 ' O ' ' HA ' ' A' ' 37' ' ' THR . 60.0 m-80 -154.37 154.11 32.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.706 0.288 . . . . 0.0 111.024 179.993 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 1.019 ' C ' HD13 ' A' ' 43' ' ' LEU . . . -100.46 111.12 23.34 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.91 179.882 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 1.019 HD13 ' C ' ' A' ' 42' ' ' ALA . 0.0 OUTLIER -119.94 131.4 55.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.385 -179.631 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.505 ' O ' ' HA ' ' A' ' 56' ' ' CYS . 2.4 t -77.83 128.61 38.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 178.762 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.561 ' SG ' ' CE1' ' A' ' 54' ' ' PHE . 1.5 m -110.1 144.19 39.07 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.014 0.435 . . . . 0.0 111.592 -179.151 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.449 ' O ' ' CD1' ' A' ' 48' ' ' TYR . 29.3 m -134.53 110.42 9.34 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.764 179.442 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.44 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 15.2 t -67.54 138.31 56.4 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.954 -179.691 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.526 ' O ' ' CG2' ' A' ' 30' ' ' ILE . 2.0 m-85 -105.38 -51.85 2.94 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.958 179.984 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 128.27 -179.69 16.4 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.749 -0.738 . . . . 0.0 112.427 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 41.15 -121.45 2.09 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.452 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -108.29 2.48 22.67 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.667 0.27 . . . . 0.0 111.093 -179.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.425 ' O ' ' O ' ' A' ' 53' ' ' GLY . 61.5 mtt180 -59.24 -42.09 90.29 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.944 179.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . 0.425 ' O ' ' O ' ' A' ' 52' ' ' ARG . . . 59.04 143.71 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.764 -0.731 . . . . 0.0 112.431 -179.921 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.561 ' CE1' ' SG ' ' A' ' 45' ' ' CYS . 1.3 p90 -58.03 150.28 21.28 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.943 0.401 . . . . 0.0 110.947 -179.926 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -104.46 -33.96 8.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.652 179.869 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.505 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.1 OUTLIER 59.27 148.29 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.051 179.864 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -130.08 -88.9 0.49 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.963 -179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.475 ' HA ' ' HA ' ' A' ' 43' ' ' LEU . 0.4 OUTLIER -158.0 -162.96 1.22 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.874 -179.967 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.503 ' O ' ' N ' ' A' ' 61' ' ' GLU . 0.0 OUTLIER -144.84 89.0 6.74 Favored Pre-proline 0 C--N 1.331 -0.217 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.974 -179.918 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 33.8 Cg_exo -57.56 72.23 0.04 OUTLIER 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.763 2.309 . . . . 0.0 112.214 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.503 ' N ' ' O ' ' A' ' 59' ' ' LYS . 2.0 pt-20 -70.85 -17.89 62.72 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.999 -179.933 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -82.67 112.55 19.64 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.15 -179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.441 ' CD ' ' CG2' ' A' ' 65' ' ' THR . 0.2 OUTLIER -62.65 -25.79 68.31 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.134 179.977 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 46.83 62.35 2.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.904 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.441 ' CG2' ' CD ' ' A' ' 63' ' ' GLU . 7.3 t -178.31 -160.11 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.189 -179.931 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.617 ' O ' HG23 ' A' ' 74' ' ' THR . 2.0 p -175.63 -178.0 1.04 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.869 -179.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -136.94 107.1 6.35 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.976 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . 0.498 ' O ' ' N ' ' A' ' 72' ' ' GLY . 12.2 t70 -78.29 67.02 4.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.745 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.402 ' HG3' ' CD1' ' A' ' 70' ' ' TYR . 10.9 ptmt -41.27 -32.16 0.27 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.026 -179.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.458 ' CD1' ' N ' ' A' ' 70' ' ' TYR . 1.7 m-30 -57.17 -33.13 67.14 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.858 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 3.9 m -126.46 -43.24 1.76 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.175 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . 0.498 ' N ' ' O ' ' A' ' 68' ' ' ASP . . . 111.37 1.61 27.89 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.476 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -89.22 111.69 22.55 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.731 0.3 . . . . 0.0 110.892 179.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.617 HG23 ' O ' ' A' ' 66' ' ' CYS . 55.5 m -64.81 128.67 36.73 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.018 179.878 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.448 ' CE2' ' HB2' ' A' ' 68' ' ' ASP . 27.7 m-85 -116.19 -171.65 2.03 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.769 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 5.7 ttt180 -103.24 129.97 50.35 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.808 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.441 ' HA ' ' O ' ' A' ' 94' ' ' CYS . 14.0 p -49.44 -36.63 10.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.211 -179.941 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -78.2 5.92 52.7 Favored Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.525 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -114.17 119.44 37.08 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.854 0.359 . . . . 0.0 110.961 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -94.83 146.91 23.88 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.165 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.468 ' CE2' ' OD1' ' A' ' 68' ' ' ASP . 3.0 p90 -146.86 121.84 10.04 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.91 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -85.13 148.91 25.88 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.814 179.883 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.414 ' O ' ' HG2' ' A' ' 85' ' ' LYS . 0.0 OUTLIER -152.52 118.63 3.03 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.002 179.963 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.433 ' HA ' ' HA ' ' A' ' 89' ' ' ILE . 50.5 Cg_exo -53.81 85.93 0.03 OUTLIER 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 122.706 2.271 . . . . 0.0 112.22 179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.452 ' O ' ' N ' ' A' ' 87' ' ' SER . 8.4 mmtm -87.59 160.94 18.0 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.976 -179.839 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 49.7 m-20 45.37 -92.02 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.022 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.452 ' N ' ' O ' ' A' ' 85' ' ' LYS . 1.4 m -143.83 20.65 1.81 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.963 -179.935 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 10.6 ttm -152.03 173.33 15.01 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.795 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.451 ' O ' ' HA ' ' A' ' 106' ' ' ILE . 1.8 mt -101.22 125.95 55.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.143 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . 0.622 ' CD1' ' N ' ' A' ' 90' ' ' TRP . 0.2 OUTLIER -126.14 130.29 50.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.854 -179.937 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.46 ' N ' ' O ' ' A' ' 105' ' ' THR . 24.7 t0 -65.59 63.61 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.838 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . 0.47 ' HA ' ' HA ' ' A' ' 104' ' ' CYS . 8.3 m -51.13 93.38 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.991 -179.91 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.475 ' N ' ' O ' ' A' ' 103' ' ' SER . 0.2 OUTLIER -82.9 130.26 35.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.021 179.936 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.441 ' O ' ' HA ' ' A' ' 77' ' ' VAL . 0.7 OUTLIER -75.91 56.89 1.0 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.997 -179.847 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.466 HG13 ' HB ' ' A' ' 93' ' ' THR . 2.0 mt -73.54 72.62 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.12 179.96 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -127.74 84.29 0.33 Allowed Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.563 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -121.99 80.71 1.73 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.852 0.358 . . . . 0.0 111.054 179.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 113.72 6.75 20.94 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.398 -179.835 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -164.86 -60.55 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.837 0.351 . . . . 0.0 110.854 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 114.45 80.19 0.91 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.719 -0.753 . . . . 0.0 112.475 -179.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.92 102.53 7.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.791 0.329 . . . . 0.0 110.942 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.57 ' N ' HD13 ' A' ' 102' ' ' ILE . 2.5 mm -85.1 76.36 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.159 179.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.475 ' O ' ' N ' ' A' ' 93' ' ' THR . 3.3 t -63.24 135.51 57.13 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.935 -179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.47 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 39.4 m -124.73 152.63 43.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.818 -179.993 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . 0.46 ' O ' ' N ' ' A' ' 91' ' ' ASP . 2.7 t -162.11 141.28 9.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.157 179.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.451 ' HA ' ' O ' ' A' ' 89' ' ' ILE . 0.8 OUTLIER -68.06 149.0 11.6 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.064 179.846 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -156.87 136.71 12.5 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.154 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -112.34 114.55 27.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.959 -179.915 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 11.0 mmt180 . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.153 -0.927 . . . . 0.0 110.899 179.856 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.5 t . . . . . 0 N--CA 1.487 1.415 0 CA-C-O 120.822 0.344 . . . . 0.0 111.15 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 41.5 mmtt -110.99 81.6 2.73 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.985 -179.888 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 90.9 Cg_endo -79.36 124.16 5.79 Favored 'Trans proline' 0 N--CA 1.464 -0.248 0 C-N-CA 122.813 2.342 . . . . 0.0 112.436 179.972 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 119.82 168.44 13.86 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.706 179.958 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 98.0 m -118.42 109.85 16.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.806 0.336 . . . . 0.0 110.84 179.924 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 79.5 t80 -96.67 116.32 28.93 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.954 -179.904 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -159.22 153.51 23.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.885 -179.971 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.427 ' CG ' ' O ' ' A' ' 24' ' ' ASN . 23.7 t-20 55.89 33.65 22.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.896 179.998 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 68.42 12.8 64.29 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.555 -179.982 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.483 ' HB3' ' CE1' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -123.07 140.57 52.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.834 0.35 . . . . 0.0 110.918 179.983 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 5.6 t-160 -116.1 91.86 3.72 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.003 -179.826 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.582 ' CE2' ' CE2' ' A' ' 34' ' ' TRP . 0.1 OUTLIER -81.2 -179.2 7.25 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.019 179.932 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.519 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 0.0 OUTLIER -110.42 145.08 38.22 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.835 179.946 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.668 HD12 ' H ' ' A' ' 30' ' ' ILE . 3.7 mp -41.26 148.27 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.395 -179.898 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.423 ' HB2' ' O ' ' A' ' 30' ' ' ILE . 71.5 m-80 66.63 12.92 9.09 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.136 179.801 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.519 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 56.1 tt0 -101.67 155.62 18.0 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.014 0.435 . . . . 0.0 111.23 -179.973 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.485 ' HG2' ' OG1' ' A' ' 46' ' ' THR . 23.2 mt-30 -119.34 158.83 25.32 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.632 179.944 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . 0.585 ' CE2' ' HB3' ' A' ' 45' ' ' CYS . 43.8 p90 -162.95 176.07 10.53 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.03 -179.964 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -107.11 113.69 27.3 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.087 -179.872 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.517 ' N ' ' O ' ' A' ' 43' ' ' LEU . 0.0 OUTLIER -97.48 178.18 5.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.805 179.92 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -147.39 140.58 25.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.667 -179.796 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 11.7 t80 -160.12 140.07 11.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.729 179.808 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 57.0 23.85 8.82 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.784 -179.879 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 75.52 32.86 53.95 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.888 -0.673 . . . . 0.0 112.747 179.819 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.454 ' O ' HD13 ' A' ' 43' ' ' LEU . 91.0 m-20 -136.38 148.36 47.79 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 120.875 0.369 . . . . 0.0 110.984 179.796 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.612 ' O ' HD12 ' A' ' 43' ' ' LEU . . . -71.65 133.82 45.94 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.767 179.841 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.612 HD12 ' O ' ' A' ' 42' ' ' ALA . 10.0 mp -126.44 153.34 45.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.358 -179.649 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.469 ' O ' ' HB3' ' A' ' 56' ' ' CYS . 2.2 t -113.02 124.14 69.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.026 -0.534 . . . . 0.0 109.904 179.033 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.585 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 9.4 m -113.28 161.71 16.89 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.902 -178.838 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.485 ' OG1' ' HG2' ' A' ' 33' ' ' GLN . 55.2 m -151.63 109.87 3.74 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.664 179.638 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.555 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 16.9 t -66.83 145.22 55.72 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.407 -0.361 . . . . 0.0 110.971 -179.765 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.484 ' CE1' ' O ' ' A' ' 46' ' ' THR . 4.0 m-85 -115.47 -42.51 3.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.852 -179.956 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 149.32 41.16 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.422 -179.901 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 49.42 47.49 35.6 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.487 -179.958 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 71.1 p -156.04 -58.9 0.1 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.841 0.353 . . . . 0.0 110.785 -179.977 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 13.7 mtp180 -75.96 1.17 16.01 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.078 179.984 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 62.35 116.89 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.743 -0.742 . . . . 0.0 112.519 179.948 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.567 ' CG ' ' O ' ' A' ' 54' ' ' PHE . 15.1 p90 -56.47 99.03 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.832 0.348 . . . . 0.0 110.836 179.976 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -72.45 140.56 48.36 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.955 -179.919 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.496 ' SG ' ' CD2' ' A' ' 54' ' ' PHE . 2.3 m -145.99 175.18 10.64 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.933 -179.916 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -171.03 -174.17 1.46 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.918 -179.95 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.414 ' O ' ' C ' ' A' ' 59' ' ' LYS . 5.0 p -79.77 136.24 36.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.876 179.993 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.414 ' C ' ' O ' ' A' ' 58' ' ' SER . 0.0 OUTLIER -36.69 107.85 0.38 Allowed Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.902 -179.927 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -48.68 -176.64 0.0 OUTLIER 'Trans proline' 0 N--CA 1.465 -0.165 0 C-N-CA 122.823 2.349 . . . . 0.0 112.262 179.876 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -133.06 6.3 3.9 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.137 179.978 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -46.85 97.93 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.898 0.38 . . . . 0.0 111.024 179.933 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -104.84 -20.52 13.56 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.697 -179.882 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.481 ' C ' HG22 ' A' ' 65' ' ' THR . 3.0 tt0 -73.62 88.09 1.68 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.887 -179.888 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.496 ' OG1' ' N ' ' A' ' 66' ' ' CYS . 0.5 OUTLIER -168.58 176.63 5.6 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.079 179.918 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.496 ' N ' ' OG1' ' A' ' 65' ' ' THR . 0.1 OUTLIER 177.53 -66.07 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.923 -179.949 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.438 ' O ' ' N ' ' A' ' 69' ' ' LYS . 46.2 t80 63.28 74.82 0.41 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.951 179.935 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . 0.514 ' O ' ' N ' ' A' ' 72' ' ' GLY . 15.0 t70 -41.27 95.19 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.85 179.982 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.438 ' N ' ' O ' ' A' ' 67' ' ' PHE . 2.2 pttm -57.11 -17.41 10.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.916 -179.926 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -65.84 -56.27 12.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.102 -179.866 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.99 7.04 14.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.277 -179.904 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . 0.514 ' N ' ' O ' ' A' ' 68' ' ' ASP . . . 59.77 31.62 72.15 Favored Glycine 0 N--CA 1.45 -0.427 0 C-N-CA 120.69 -0.767 . . . . 0.0 112.382 179.947 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -84.05 -172.96 4.45 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.852 0.358 . . . . 0.0 110.773 179.93 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 15.8 m -111.03 79.06 1.16 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.968 179.925 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.456 ' CD2' ' HB2' ' A' ' 68' ' ' ASP . 11.1 m-30 -89.46 169.56 11.27 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.893 -179.99 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.426 ' NE ' ' OE2' ' A' ' 64' ' ' GLU . 0.0 OUTLIER -128.01 135.97 50.63 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.766 -179.966 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.454 ' HA ' ' O ' ' A' ' 94' ' ' CYS . 2.3 p -48.53 -26.53 1.46 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.945 -179.965 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -90.1 8.25 80.14 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.513 -179.955 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -125.43 127.51 46.64 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.849 0.357 . . . . 0.0 110.787 179.966 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 5.0 t -103.35 150.8 23.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.148 -179.874 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.498 ' CG ' ' O ' ' A' ' 81' ' ' TYR . 25.9 p90 -140.84 112.09 7.29 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.824 179.844 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.486 ' CB ' ' OD1' ' A' ' 91' ' ' ASP . 6.1 pt-20 -86.12 136.12 33.34 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.974 -179.835 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.442 ' HA ' ' HD2' ' A' ' 84' ' ' PRO . 4.4 mtt180 -110.59 106.79 58.04 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.815 -179.991 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.451 ' HA ' HG12 ' A' ' 89' ' ' ILE . 34.0 Cg_endo -64.62 88.35 0.17 Allowed 'Trans proline' 0 C--O 1.231 0.156 0 C-N-CA 122.784 2.323 . . . . 0.0 112.283 179.983 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 2.4 mttm -126.74 126.32 43.26 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.934 179.995 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.491 ' CB ' ' SD ' ' A' ' 88' ' ' MET . 0.4 OUTLIER 67.92 177.42 0.25 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.841 179.905 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.2 m -84.99 55.58 3.55 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.945 -179.987 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.491 ' SD ' ' CB ' ' A' ' 86' ' ' ASP . 0.0 OUTLIER -150.23 -47.41 0.13 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.83 -179.947 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.484 ' C ' ' CD1' ' A' ' 90' ' ' TRP . 35.6 mt 62.76 137.4 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.839 179.97 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . 0.604 ' CD1' ' N ' ' A' ' 90' ' ' TRP . 0.1 OUTLIER -142.67 124.55 15.16 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.934 -179.881 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.486 ' OD1' ' CB ' ' A' ' 82' ' ' GLU . 93.8 m-20 -75.21 72.89 2.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.939 179.983 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . 0.476 ' HA ' ' O ' ' A' ' 103' ' ' SER . 0.1 OUTLIER -52.34 99.19 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.956 179.879 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 2.5 m -80.88 127.92 33.09 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.008 179.903 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.672 ' HA ' HD12 ' A' ' 102' ' ' ILE . 1.8 t -70.49 72.55 0.5 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.989 -179.856 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 1.9 mt -67.99 149.12 11.55 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.162 179.97 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -159.92 -102.82 0.18 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.783 -0.722 . . . . 0.0 112.644 -179.947 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . 48.69 37.78 10.21 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.836 0.351 . . . . 0.0 111.019 -179.914 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . 120.43 -38.42 2.74 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.763 -0.732 . . . . 0.0 112.506 179.999 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.22 99.78 6.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.769 0.318 . . . . 0.0 110.882 -179.926 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -69.96 77.62 0.41 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.433 179.93 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -120.8 93.73 4.12 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.805 0.336 . . . . 0.0 110.961 -179.983 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.672 HD12 ' HA ' ' A' ' 94' ' ' CYS . 6.6 mm -60.75 123.91 14.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.124 179.906 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.476 ' O ' ' HA ' ' A' ' 92' ' ' CYS . 25.3 t -105.93 125.81 51.44 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.991 -179.92 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.45 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 0.5 OUTLIER -102.27 86.5 2.84 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.962 -179.924 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 4.7 t -73.12 131.75 42.44 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.113 179.918 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.575 ' HB ' ' CZ3' ' A' ' 90' ' ' TRP . 0.9 OUTLIER -62.87 148.78 10.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.959 179.794 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.451 ' HB3' ' O ' ' A' ' 88' ' ' MET . . . -77.6 168.52 19.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.019 179.941 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -175.54 145.1 0.71 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.891 -179.961 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 4.1 mtt180 . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.855 -179.98 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.503 ' OG ' ' N ' ' A' ' 18' ' ' LYS . 14.1 t . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.837 0.351 . . . . 0.0 111.095 . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.503 ' N ' ' OG ' ' A' ' 17' ' ' SER . 44.0 tttt -155.35 129.75 4.86 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.983 179.952 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 18' ' ' LYS . 39.6 Cg_exo -57.1 -165.33 0.02 OUTLIER 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.888 2.392 . . . . 0.0 112.256 179.943 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.527 ' H ' HD11 ' A' ' 30' ' ' ILE . . . 82.33 122.87 0.72 Allowed Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.572 179.947 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.483 ' O ' ' HB2' ' A' ' 22' ' ' TYR . 11.7 m -79.49 -179.91 7.09 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.83 0.347 . . . . 0.0 110.752 179.781 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.483 ' HB2' ' O ' ' A' ' 21' ' ' CYS . 85.7 t80 174.93 119.35 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.919 179.942 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -153.95 156.89 38.32 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.856 -179.996 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.4 ' CG ' ' O ' ' A' ' 24' ' ' ASN . 29.3 t-20 48.35 27.47 1.37 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.88 -179.943 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.06 -3.55 70.56 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.689 -0.767 . . . . 0.0 112.523 179.965 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.586 ' HB3' ' CZ ' ' A' ' 28' ' ' TYR . 0.9 OUTLIER -91.95 135.52 33.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.837 0.351 . . . . 0.0 110.852 -179.986 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 3.9 t-160 -113.47 90.82 3.44 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.997 -179.984 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.586 ' CZ ' ' HB3' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -84.98 142.61 29.5 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.988 179.938 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.526 ' O ' ' CB ' ' A' ' 32' ' ' GLN . 6.7 mt-30 -76.39 147.0 38.32 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.587 179.771 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.828 HD13 ' SG ' ' A' ' 47' ' ' CYS . 7.6 mm -49.5 147.59 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-O 120.961 0.41 . . . . 0.0 110.982 179.979 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.431 ' CG ' HG22 ' A' ' 30' ' ' ILE . 61.3 m-20 67.1 7.77 5.67 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.042 179.956 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.526 ' CB ' ' O ' ' A' ' 29' ' ' GLN . 1.5 tt0 -92.76 151.79 19.84 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.849 0.356 . . . . 0.0 110.9 179.932 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -124.8 136.54 53.92 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.043 -179.826 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . 0.595 ' CZ3' ' HB2' ' A' ' 47' ' ' CYS . 19.3 p90 -134.86 -170.96 2.67 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.759 179.876 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.5 ' HG3' HG22 ' A' ' 44' ' ' VAL . 2.2 mt-10 -130.76 125.17 33.12 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.922 0.391 . . . . 0.0 111.159 -179.868 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.47 ' O ' ' HB2' ' A' ' 43' ' ' LEU . 0.1 OUTLIER -122.85 172.89 8.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.74 179.742 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -126.37 143.94 51.0 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.757 -179.769 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -155.92 125.45 6.32 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.611 179.769 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 74.36 14.61 3.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.522 -179.879 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 80.01 45.49 8.27 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.611 -179.957 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 7.5 m-80 -149.46 168.33 23.74 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 120.789 0.328 . . . . 0.0 110.995 179.865 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.783 ' C ' HD12 ' A' ' 43' ' ' LEU . . . -82.82 132.08 35.18 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.953 179.805 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.783 HD12 ' C ' ' A' ' 42' ' ' ALA . 10.3 mp -136.52 146.28 46.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.972 0.415 . . . . 0.0 111.311 -179.718 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.5 HG22 ' HG3' ' A' ' 35' ' ' GLU . 2.4 t -114.74 130.6 68.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.139 179.05 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.593 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 1.3 m -112.06 166.54 11.15 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.096 0.474 . . . . 0.0 111.537 -179.323 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.467 ' O ' ' HB2' ' A' ' 54' ' ' PHE . 27.9 m -143.52 147.56 34.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.663 -0.698 . . . . 0.0 110.69 179.704 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.828 ' SG ' HD13 ' A' ' 30' ' ' ILE . 21.9 t -106.88 143.91 34.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.937 -179.825 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.44 ' CD1' ' N ' ' A' ' 48' ' ' TYR . 3.1 m-85 -130.37 -47.08 1.08 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.919 179.906 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 99.91 -50.22 1.12 Allowed Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.793 -0.718 . . . . 0.0 112.428 -179.921 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -70.46 -152.88 0.91 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.794 -0.717 . . . . 0.0 112.486 179.913 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.12 -6.14 45.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.7 0.286 . . . . 0.0 111.016 179.986 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 1.3 mtt180 -62.68 -38.25 89.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.106 -179.932 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 61.42 155.82 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.657 -0.782 . . . . 0.0 112.303 -179.887 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.558 ' CE1' ' SG ' ' A' ' 45' ' ' CYS . 0.2 OUTLIER -72.88 126.59 30.29 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.794 0.33 . . . . 0.0 110.818 -179.966 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 43.9 m-80 -120.47 118.27 29.84 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.767 179.97 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.49 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.1 OUTLIER -89.28 167.27 13.2 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.061 -179.837 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -151.24 151.04 31.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.836 179.938 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.462 ' O ' ' O ' ' A' ' 59' ' ' LYS . 4.9 p -72.19 77.94 0.97 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.968 -179.933 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.462 ' O ' ' O ' ' A' ' 58' ' ' SER . 12.3 tptt 38.69 97.08 0.04 OUTLIER Pre-proline 0 C--N 1.33 -0.27 0 CA-C-N 116.224 -0.443 . . . . 0.0 111.048 179.883 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.412 ' HD2' ' HA ' ' A' ' 59' ' ' LYS . 50.5 Cg_endo -69.24 -167.31 0.2 Allowed 'Trans proline' 0 N--CA 1.465 -0.164 0 C-N-CA 122.825 2.35 . . . . 0.0 112.275 179.882 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -134.55 24.89 3.75 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.947 179.91 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -52.71 145.24 12.48 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.073 179.959 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -90.1 122.53 33.15 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.481 179.944 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.507 ' HB3' HG11 ' A' ' 77' ' ' VAL . 1.8 mp0 -151.53 122.31 7.52 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.964 -179.866 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.459 ' O ' ' HA3' ' A' ' 96' ' ' GLY . 0.0 OUTLIER -173.91 -172.01 0.69 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.0 179.96 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.459 ' O ' HG23 ' A' ' 74' ' ' THR . 1.7 p -171.5 171.47 5.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.961 179.959 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -160.6 106.74 1.49 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.027 179.998 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 50.2 t0 -70.44 88.05 0.65 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.825 179.965 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.426 ' O ' ' C ' ' A' ' 70' ' ' TYR . 0.5 OUTLIER -59.35 -37.44 77.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.997 -179.975 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.426 ' C ' ' O ' ' A' ' 69' ' ' LYS . 10.5 m-30 -36.13 -40.57 0.22 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.863 179.949 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 91.2 m -121.58 -30.45 4.2 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.138 179.88 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 107.18 14.14 19.39 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.773 -0.727 . . . . 0.0 112.37 -179.924 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 15.4 m-20 -92.73 176.81 6.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.923 0.392 . . . . 0.0 110.967 179.981 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.459 HG23 ' O ' ' A' ' 66' ' ' CYS . 90.0 m -132.85 136.41 46.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.959 179.88 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.459 ' CD2' ' CE2' ' A' ' 81' ' ' TYR . 34.7 m-85 -128.38 -170.72 2.3 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.74 -179.972 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 31.1 mtt-85 -99.18 124.52 44.3 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.808 179.921 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.507 HG11 ' HB3' ' A' ' 64' ' ' GLU . 7.3 p -54.0 -27.27 15.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.169 -179.93 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -79.83 -4.99 89.63 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.712 -0.756 . . . . 0.0 112.578 -179.979 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -123.17 -174.52 2.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.833 0.349 . . . . 0.0 110.98 -179.989 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 13.6 t -144.63 -174.68 4.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.979 -179.98 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.459 ' CE2' ' CD2' ' A' ' 75' ' ' TYR . 33.3 p90 -159.92 153.85 23.07 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.952 179.963 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 54.4 tt0 -82.88 140.77 32.69 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.875 179.98 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.43 110.43 9.7 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.971 -179.883 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -74.32 98.36 1.1 Allowed 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 122.736 2.291 . . . . 0.0 112.381 179.977 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.402 ' O ' ' CB ' ' A' ' 86' ' ' ASP . 0.1 OUTLIER -131.55 123.26 27.59 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.91 -179.993 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.402 ' CB ' ' O ' ' A' ' 85' ' ' LYS . 2.6 t0 77.31 -155.18 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.924 179.954 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 59.3 p -85.26 -3.24 58.75 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.125 179.925 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . . . . . . . . . 2.7 tpt -128.09 163.91 23.58 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.352 -0.385 . . . . 0.0 110.889 -179.949 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.514 ' C ' ' CD1' ' A' ' 90' ' ' TRP . 2.3 mp -106.23 152.45 7.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.052 179.88 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . 0.618 ' CD1' ' N ' ' A' ' 90' ' ' TRP . 0.1 OUTLIER -143.81 141.81 30.57 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.963 -179.986 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -91.34 70.85 6.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.924 179.963 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . 0.426 ' HA ' ' HA ' ' A' ' 104' ' ' CYS . 72.1 m -47.9 99.95 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.039 -179.958 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.513 ' O ' HG23 ' A' ' 102' ' ' ILE . 0.2 OUTLIER -71.26 122.29 19.97 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.879 179.896 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -63.76 86.47 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.938 -179.84 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.833 HG22 ' CA ' ' A' ' 100' ' ' GLY . 1.1 mt -100.0 102.11 13.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.125 -0.488 . . . . 0.0 111.147 -179.948 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.624 ' O ' ' HB3' ' A' ' 97' ' ' ALA . . . -112.08 -136.53 6.86 Favored Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.706 -179.969 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.624 ' HB3' ' O ' ' A' ' 96' ' ' GLY . . . 79.76 -157.46 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.632 0.253 . . . . 0.0 110.875 -179.776 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . . . . . . . . . . . -42.36 -30.83 0.87 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.515 -0.85 . . . . 0.0 112.204 179.871 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.51 ' O ' ' N ' ' A' ' 101' ' ' ARG . 3.9 ttp180 -155.69 -55.03 0.09 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.846 0.355 . . . . 0.0 110.377 179.824 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 0.833 ' CA ' HG22 ' A' ' 95' ' ' ILE . . . 58.14 -75.22 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.952 -0.642 . . . . 0.0 112.779 179.667 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.521 ' CD ' ' O ' ' A' ' 101' ' ' ARG . 0.0 OUTLIER 69.11 87.07 0.12 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.831 0.348 . . . . 0.0 110.494 -179.733 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.599 ' H ' HD12 ' A' ' 102' ' ' ILE . 3.7 mp -41.2 122.13 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.18 179.96 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.475 ' HB2' ' NH2' ' A' ' 101' ' ' ARG . 19.5 t -105.38 133.01 50.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.929 -179.913 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.426 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 38.3 m -112.32 132.1 55.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.883 179.902 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . 0.412 ' O ' ' HA ' ' A' ' 90' ' ' TRP . 5.0 t -140.72 143.67 35.14 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.216 -179.931 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.466 ' HA ' ' O ' ' A' ' 89' ' ' ILE . 5.8 mt -47.91 155.24 0.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.902 179.919 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.429 ' N ' ' CG2' ' A' ' 106' ' ' ILE . . . -90.59 111.95 23.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.059 -179.99 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -92.65 154.52 18.32 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.863 -179.941 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 15.1 ptt85 . . . . . 0 C--O 1.248 0.985 0 CA-C-O 118.273 -0.87 . . . . 0.0 110.875 -179.919 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.414 ' O ' ' C ' ' A' ' 18' ' ' LYS . 3.5 t . . . . . 0 N--CA 1.486 1.334 0 CA-C-O 120.836 0.35 . . . . 0.0 111.284 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.414 ' C ' ' O ' ' A' ' 17' ' ' SER . 0.0 OUTLIER 36.82 67.65 1.7 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.958 179.956 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.433 ' HB2' HD11 ' A' ' 30' ' ' ILE . 32.5 Cg_exo -57.74 157.42 23.74 Favored 'Trans proline' 0 C--N 1.341 0.136 0 C-N-CA 122.771 2.314 . . . . 0.0 112.178 179.997 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 152.18 -162.06 29.64 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.735 -0.745 . . . . 0.0 112.514 -179.976 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 17.1 m -152.67 97.92 2.29 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.916 0.388 . . . . 0.0 110.819 179.979 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -71.83 135.21 46.56 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.982 -179.986 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.411 ' HB3' ' ND2' ' A' ' 24' ' ' ASN . 0.2 OUTLIER -157.48 121.98 4.34 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.95 179.995 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.411 ' ND2' ' HB3' ' A' ' 23' ' ' ASP . 3.1 p30 44.62 47.42 8.59 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.048 179.934 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 71.11 2.17 45.79 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.638 179.924 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.403 ' HB3' ' CZ ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -103.26 133.33 48.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.834 0.349 . . . . 0.0 110.906 179.961 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -116.73 91.94 3.73 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.963 -179.769 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.598 ' CE2' ' CE2' ' A' ' 34' ' ' TRP . 3.2 m-85 -79.79 130.52 35.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.317 -0.402 . . . . 0.0 110.946 -179.955 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.47 ' O ' ' HB2' ' A' ' 32' ' ' GLN . 3.2 tt0 -63.25 135.05 56.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.599 179.891 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.717 HG23 ' C ' ' A' ' 48' ' ' TYR . 4.2 mp -31.85 139.07 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.512 -179.924 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.476 ' N ' ' O ' ' A' ' 47' ' ' CYS . 61.0 m-20 78.11 0.74 2.72 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.124 -179.78 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.47 ' HB2' ' O ' ' A' ' 29' ' ' GLN . 6.3 mm100 -76.94 141.71 40.36 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.819 0.342 . . . . 0.0 110.885 179.81 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . 0.487 ' HG2' HG23 ' A' ' 46' ' ' THR . 11.4 mt-30 -114.13 132.33 56.1 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.037 -179.962 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . 0.598 ' CE2' ' CE2' ' A' ' 28' ' ' TYR . 42.6 p90 -148.61 -168.46 3.1 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.921 -179.935 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -122.44 132.78 54.51 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.967 -179.799 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 1.0 ' O ' HD22 ' A' ' 43' ' ' LEU . 0.4 OUTLIER -119.95 167.56 12.03 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.773 179.879 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.776 HG22 ' O ' ' A' ' 41' ' ' ASN . 0.1 OUTLIER -109.43 164.23 12.69 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.086 -179.86 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.582 ' HB2' HD21 ' A' ' 43' ' ' LEU . 0.1 OUTLIER -156.14 93.01 1.39 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.651 179.91 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.45 HD13 ' HA ' ' A' ' 39' ' ' LEU . 0.8 OUTLIER 67.2 18.59 10.36 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.694 -179.707 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 107.11 8.97 30.67 Favored Glycine 0 N--CA 1.446 -0.676 0 C-N-CA 120.811 -0.709 . . . . 0.0 112.62 179.996 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.776 ' O ' HG22 ' A' ' 37' ' ' THR . 50.1 m-80 -94.78 -173.11 2.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.852 0.358 . . . . 0.0 111.018 -179.908 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.957 ' C ' HD13 ' A' ' 43' ' ' LEU . . . -135.48 107.83 7.31 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.924 179.844 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 1.0 HD22 ' O ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -121.89 157.59 30.85 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.156 -179.889 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.467 ' O ' ' HB3' ' A' ' 56' ' ' CYS . 2.8 t -95.8 132.09 40.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.176 -0.466 . . . . 0.0 109.934 179.122 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.54 ' HB3' ' CE2' ' A' ' 34' ' ' TRP . 1.8 m -114.29 157.17 23.12 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.738 -179.092 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.487 HG23 ' HG2' ' A' ' 33' ' ' GLN . 4.6 m -146.18 130.81 17.88 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.599 179.545 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.51 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 20.0 t -83.79 139.16 32.87 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.029 -179.644 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.717 ' C ' HG23 ' A' ' 30' ' ' ILE . 5.5 m-85 -119.56 -14.93 9.06 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.967 -179.925 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.517 ' HA2' ' CG1' ' A' ' 30' ' ' ILE . . . 132.09 -165.22 23.6 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.557 179.94 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . 0.514 ' O ' ' CB ' ' A' ' 51' ' ' SER . . . -91.98 67.09 2.12 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.757 -0.735 . . . . 0.0 112.534 -179.977 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.514 ' CB ' ' O ' ' A' ' 50' ' ' GLY . 0.1 OUTLIER 159.66 -51.73 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.756 0.312 . . . . 0.0 110.908 179.99 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 9.5 mtt-85 -57.27 -19.08 19.54 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.904 179.925 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . 0.472 ' O ' ' CD1' ' A' ' 48' ' ' TYR . . . 73.54 172.46 24.76 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.597 179.832 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.577 ' CG ' ' O ' ' A' ' 54' ' ' PHE . 11.3 p90 -114.23 96.59 5.87 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.828 0.346 . . . . 0.0 110.838 179.989 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 61.0 m-20 -71.14 138.31 49.54 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.708 179.991 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.506 ' SG ' ' CD2' ' A' ' 54' ' ' PHE . 3.0 m -144.2 162.11 37.17 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.942 0.401 . . . . 0.0 111.231 -179.648 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.458 ' O ' ' O ' ' A' ' 58' ' ' SER . 0.5 OUTLIER -162.72 160.9 26.03 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.771 179.857 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.458 ' O ' ' O ' ' A' ' 57' ' ' GLU . 0.6 OUTLIER -37.3 161.01 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.945 179.993 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -103.2 107.57 55.97 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.034 -179.932 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -76.56 124.52 7.69 Favored 'Trans proline' 0 N--CA 1.464 -0.228 0 C-N-CA 122.82 2.347 . . . . 0.0 112.416 -179.994 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -111.09 -23.82 10.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.703 179.858 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -131.52 125.45 32.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.004 179.886 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -91.01 -27.09 18.87 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.609 -179.972 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.762 ' O ' HG23 ' A' ' 65' ' ' THR . 5.8 tt0 66.26 114.37 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.921 179.86 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.762 HG23 ' O ' ' A' ' 64' ' ' GLU . 0.2 OUTLIER 171.82 169.33 0.1 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.195 179.985 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.442 ' HB2' ' C ' ' A' ' 75' ' ' TYR . 0.8 OUTLIER -153.05 -175.09 5.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.783 179.98 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -129.78 -37.22 1.55 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.943 -179.928 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . 0.445 ' O ' ' O ' ' A' ' 69' ' ' LYS . 27.3 t0 59.98 63.99 1.35 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.806 179.997 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.445 ' O ' ' O ' ' A' ' 68' ' ' ASP . 9.7 ptmt -45.44 176.07 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.882 179.98 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.872 ' O ' HG23 ' A' ' 71' ' ' THR . 20.4 m-85 65.37 17.78 11.1 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.955 -179.997 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.872 HG23 ' O ' ' A' ' 70' ' ' TYR . 0.7 OUTLIER -177.75 -34.47 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.218 -179.994 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 80.04 42.62 10.64 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.752 -0.737 . . . . 0.0 112.553 -179.991 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . 0.409 ' O ' ' CB ' ' A' ' 68' ' ' ASP . 0.1 OUTLIER -100.58 116.12 31.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.791 0.329 . . . . 0.0 110.855 179.97 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.43 ' O ' ' NH2' ' A' ' 76' ' ' ARG . 5.2 m -70.61 100.47 1.84 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.101 179.957 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.442 ' C ' ' HB2' ' A' ' 66' ' ' CYS . 3.9 m-30 -92.29 -174.49 3.74 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.853 -179.953 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . 0.43 ' NH2' ' O ' ' A' ' 74' ' ' THR . 0.6 OUTLIER -129.69 157.71 41.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.808 179.938 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.489 ' HB ' ' HG3' ' A' ' 64' ' ' GLU . 75.7 t -63.67 -20.57 26.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.136 179.941 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -91.18 31.0 5.91 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.755 -0.736 . . . . 0.0 112.461 179.933 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -148.9 148.44 29.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.882 0.372 . . . . 0.0 111.114 179.971 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.776 HG22 HG23 ' A' ' 93' ' ' THR . 80.6 p -125.39 169.61 12.18 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.026 179.974 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.478 ' OH ' HG21 ' A' ' 102' ' ' ILE . 11.0 p90 -174.29 134.92 0.43 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.936 179.96 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.419 ' HG3' ' HA ' ' A' ' 91' ' ' ASP . 11.6 mp0 -87.82 165.39 15.34 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.968 -179.996 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . 0.512 ' NE ' ' HD2' ' A' ' 84' ' ' PRO . 0.0 OUTLIER -148.3 113.13 3.8 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.772 179.966 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.512 ' HD2' ' NE ' ' A' ' 83' ' ' ARG . 37.4 Cg_endo -66.2 74.1 0.36 Allowed 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.699 2.266 . . . . 0.0 112.254 179.986 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.565 ' HE2' ' CE2' ' A' ' 70' ' ' TYR . 4.9 mmtt -100.08 131.06 46.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.871 -179.959 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 9.5 t0 57.23 -173.85 0.08 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.778 179.962 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.456 ' O ' ' HB2' ' A' ' 88' ' ' MET . 8.5 m -72.48 58.58 0.41 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.958 179.967 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.456 ' HB2' ' O ' ' A' ' 87' ' ' SER . 1.9 ttm 176.48 166.93 0.47 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.859 -179.999 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 1.9 mp -123.84 146.18 29.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.108 179.989 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . 0.623 ' CD1' ' N ' ' A' ' 90' ' ' TRP . 0.0 OUTLIER -137.09 139.17 41.09 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.811 -179.941 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.419 ' HA ' ' HG3' ' A' ' 82' ' ' GLU . 6.0 m-20 -77.91 63.36 2.91 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.757 179.889 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . 0.444 ' HA ' ' O ' ' A' ' 103' ' ' SER . 3.8 m -44.88 112.52 0.44 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.163 -179.895 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.776 HG23 HG22 ' A' ' 80' ' ' THR . 0.9 OUTLIER -96.48 143.49 27.45 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.78 179.771 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . 0.424 ' SG ' ' O ' ' A' ' 76' ' ' ARG . 3.5 t -74.58 81.44 1.99 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.047 -179.822 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.557 HD12 ' HB2' ' A' ' 103' ' ' SER . 2.6 mt -101.51 145.11 12.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.209 179.987 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 116.05 146.43 8.67 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.753 -0.737 . . . . 0.0 112.499 -179.914 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -89.27 45.32 1.28 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.806 0.336 . . . . 0.0 111.154 -179.91 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.405 ' O ' ' HB2' ' A' ' 99' ' ' ARG . . . 142.05 -9.45 2.5 Favored Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.649 179.849 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.518 ' O ' ' N ' ' A' ' 101' ' ' ARG . 0.9 OUTLIER 173.6 -40.84 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.782 0.325 . . . . 0.0 110.936 -179.983 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 0.404 ' C ' ' O ' ' A' ' 99' ' ' ARG . . . 38.16 -91.5 0.01 OUTLIER Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.683 -0.77 . . . . 0.0 112.384 -179.958 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.518 ' N ' ' O ' ' A' ' 99' ' ' ARG . 0.0 OUTLIER -179.03 33.68 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.748 0.309 . . . . 0.0 110.982 179.758 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.478 HG21 ' OH ' ' A' ' 81' ' ' TYR . 3.2 mt 28.55 89.26 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.671 179.756 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.557 ' HB2' HD12 ' A' ' 95' ' ' ILE . 1.4 t -55.78 148.49 16.52 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.868 179.941 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.447 ' SG ' ' O ' ' A' ' 103' ' ' SER . 18.5 m -157.17 142.82 17.52 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.973 -179.939 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -162.18 134.61 5.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.069 179.996 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.578 HG13 ' CE3' ' A' ' 90' ' ' TRP . 3.5 mt -51.15 142.12 3.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.213 -0.448 . . . . 0.0 111.086 179.887 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -63.0 170.22 2.87 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.126 179.929 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -96.87 95.19 7.69 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.945 179.999 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.053 0 CA-C-O 118.247 -0.883 . . . . 0.0 110.924 179.969 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 50.3 m . . . . . 0 N--CA 1.487 1.384 0 CA-C-O 120.8 0.333 . . . . 0.0 111.081 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 1.7 pttp -176.24 96.35 0.25 Allowed Pre-proline 0 C--N 1.329 -0.291 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.987 -179.885 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -80.04 167.54 19.87 Favored 'Trans proline' 0 N--CA 1.464 -0.237 0 C-N-CA 122.841 2.361 . . . . 0.0 112.522 -179.886 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' GLY . . . . . 0.556 ' HA2' HD11 ' A' ' 30' ' ' ILE . . . 79.51 159.8 17.93 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.623 179.791 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.479 ' O ' ' CD2' ' A' ' 27' ' ' HIS . 1.6 m -92.03 174.3 7.39 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.743 0.306 . . . . 0.0 110.921 179.936 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 85.3 t80 177.61 143.98 0.1 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.864 -179.976 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 166.66 169.7 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.87 179.977 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.418 ' CG ' ' O ' ' A' ' 24' ' ' ASN . 35.1 t30 54.09 24.34 4.73 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.902 179.927 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 77.4 6.73 86.76 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.576 179.94 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.585 ' HB3' ' CE1' ' A' ' 28' ' ' TYR . 2.1 ttpt -119.74 149.48 41.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.75 0.309 . . . . 0.0 110.876 -179.985 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . 0.479 ' CD2' ' O ' ' A' ' 21' ' ' CYS . 3.0 t-160 -116.51 96.42 5.51 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.109 -179.834 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.585 ' CE1' ' HB3' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -90.73 171.53 9.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.96 -179.995 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.486 ' O ' ' HB2' ' A' ' 32' ' ' GLN . 0.1 OUTLIER -95.17 173.88 7.34 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.905 179.934 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.676 HD12 ' HA2' ' A' ' 49' ' ' GLY . 33.5 mm -72.45 148.41 9.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.166 -179.989 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 65.6 m-20 64.24 10.73 5.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.852 -179.918 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.486 ' HB2' ' O ' ' A' ' 29' ' ' GLN . 0.0 OUTLIER -88.78 158.31 18.19 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.784 -179.999 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -119.29 138.59 52.91 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.956 -179.87 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . 0.563 ' CE2' ' HB2' ' A' ' 45' ' ' CYS . 37.2 p90 -149.59 -179.77 7.36 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.037 -179.904 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.49 ' HG2' ' O ' ' A' ' 43' ' ' LEU . 3.9 tt0 -117.58 128.82 55.32 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.577 -179.991 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 36' ' ' ARG . . . . . 0.993 ' O ' HD22 ' A' ' 43' ' ' LEU . 2.9 ttt180 -114.82 169.79 8.82 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.811 0.338 . . . . 0.0 110.965 -179.985 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 1.1 m -130.05 130.48 44.97 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.644 -179.916 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -147.74 143.78 27.81 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.791 179.85 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.501 HD13 ' HA ' ' A' ' 39' ' ' LEU . 0.5 OUTLIER 51.24 35.28 13.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.681 -179.838 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 66.95 38.8 93.07 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.827 -0.701 . . . . 0.0 112.494 -179.89 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 36.3 m-20 -134.87 179.77 6.1 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 120.856 0.36 . . . . 0.0 110.934 -179.93 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.886 ' C ' HD13 ' A' ' 43' ' ' LEU . . . -125.67 118.75 26.31 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.988 179.859 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.993 HD22 ' O ' ' A' ' 36' ' ' ARG . 0.0 OUTLIER -124.9 163.67 21.74 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.961 0.41 . . . . 0.0 111.347 -179.871 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.476 ' HA ' ' HA ' ' A' ' 35' ' ' GLU . 2.4 t -111.97 125.06 69.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.092 179.163 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.563 ' HB2' ' CE2' ' A' ' 34' ' ' TRP . 89.0 m -103.66 163.75 12.11 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.789 -178.874 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.445 ' O ' ' HA ' ' A' ' 54' ' ' PHE . 21.1 m -146.13 119.28 8.85 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.601 179.708 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.539 ' HB2' ' CZ3' ' A' ' 34' ' ' TRP . 13.4 t -79.06 154.94 29.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.128 -179.61 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.423 ' C ' HG23 ' A' ' 30' ' ' ILE . 15.4 m-85 -123.49 -47.66 1.97 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.851 179.908 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.676 ' HA2' HD12 ' A' ' 30' ' ' ILE . . . 119.22 139.21 5.95 Favored Glycine 0 N--CA 1.45 -0.384 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.418 -179.888 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 78.04 -111.3 3.22 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.851 -0.69 . . . . 0.0 112.747 179.874 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -117.86 -4.14 11.14 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.721 0.296 . . . . 0.0 111.152 -179.81 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 6.5 mtt180 -55.57 -26.14 41.9 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.985 -179.896 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 69.01 -173.65 34.83 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.766 -0.73 . . . . 0.0 112.536 179.908 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.579 ' CD1' ' O ' ' A' ' 54' ' ' PHE . 29.5 p90 -129.68 122.65 29.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.893 0.378 . . . . 0.0 111.007 -179.952 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -91.2 147.73 22.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.489 179.795 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.471 ' HA ' ' O ' ' A' ' 44' ' ' VAL . 0.8 OUTLIER -137.35 156.51 48.15 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.926 0.393 . . . . 0.0 111.181 -179.834 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -144.59 133.56 22.63 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.024 -0.535 . . . . 0.0 110.797 179.923 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 22.9 t -37.43 130.52 0.95 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.057 179.972 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -39.09 118.68 1.15 Allowed Pre-proline 0 C--N 1.329 -0.29 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.87 179.899 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_exo -51.45 152.74 11.49 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.685 2.257 . . . . 0.0 112.232 179.929 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -50.54 -54.13 24.88 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.088 -179.94 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -111.21 122.76 48.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.135 -179.943 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.619 ' HG3' ' HB1' ' A' ' 97' ' ' ALA . 1.2 tt0 -113.91 -43.69 3.24 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.505 179.977 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.483 ' O ' HG23 ' A' ' 65' ' ' THR . 12.1 mt-10 -64.34 82.57 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.899 -179.77 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.483 HG23 ' O ' ' A' ' 64' ' ' GLU . 0.0 OUTLIER -177.24 166.32 2.33 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.192 179.899 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.467 ' O ' HG23 ' A' ' 74' ' ' THR . 0.8 OUTLIER -158.9 178.76 9.74 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.9 -179.817 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.437 ' O ' ' N ' ' A' ' 69' ' ' LYS . 44.8 t80 -131.49 85.04 2.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.883 179.985 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . 0.51 ' O ' ' N ' ' A' ' 72' ' ' GLY . 10.1 p-10 -53.65 86.83 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.964 179.994 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 69' ' ' LYS . . . . . 0.437 ' N ' ' O ' ' A' ' 67' ' ' PHE . 0.1 OUTLIER -40.32 -46.95 2.43 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.914 179.933 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.411 ' C ' ' O ' ' A' ' 69' ' ' LYS . 8.7 m-30 -36.59 -74.94 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.954 179.928 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -93.79 -41.38 9.69 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.019 -179.976 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 72' ' ' GLY . . . . . 0.51 ' N ' ' O ' ' A' ' 68' ' ' ASP . . . 108.02 -3.44 33.61 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.661 -0.781 . . . . 0.0 112.468 -179.994 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . 0.492 ' OD1' ' N ' ' A' ' 73' ' ' ASN . 0.3 OUTLIER -73.21 102.57 3.67 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.836 0.351 . . . . 0.0 110.848 -179.982 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.467 HG23 ' O ' ' A' ' 66' ' ' CYS . 93.1 m -41.69 134.39 2.48 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.081 179.941 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 75' ' ' TYR . . . . . 0.421 ' HB2' ' SG ' ' A' ' 66' ' ' CYS . 14.3 m-85 -122.76 -174.26 2.88 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.739 179.959 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -117.7 149.46 40.7 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.804 179.94 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.452 ' CG1' ' HG2' ' A' ' 64' ' ' GLU . 9.6 p -63.08 -28.73 45.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.374 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.085 -179.991 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -91.69 11.13 72.99 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.729 -0.748 . . . . 0.0 112.518 179.872 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -126.07 153.9 43.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.836 0.351 . . . . 0.0 110.897 179.99 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.577 ' HB ' HG23 ' A' ' 93' ' ' THR . 0.1 OUTLIER -127.07 167.68 15.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.152 -179.883 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.485 ' OH ' HG21 ' A' ' 102' ' ' ILE . 0.5 OUTLIER -149.56 154.1 38.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.885 -179.98 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -102.4 164.59 11.58 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.941 179.959 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 83' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 169.95 121.96 0.05 OUTLIER Pre-proline 0 C--N 1.329 -0.314 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.769 -179.998 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.454 ' HA ' ' HA ' ' A' ' 89' ' ' ILE . 45.4 Cg_endo -68.45 161.49 44.7 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.73 2.287 . . . . 0.0 112.421 -179.962 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.432 ' O ' ' NE1' ' A' ' 90' ' ' TRP . 11.4 tptt 173.86 161.98 0.17 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.897 179.973 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 86' ' ' ASP . . . . . 0.489 ' O ' ' CB ' ' A' ' 87' ' ' SER . 1.1 m-20 56.81 19.97 4.84 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.934 -179.98 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.489 ' CB ' ' O ' ' A' ' 86' ' ' ASP . 1.4 t 82.16 18.61 0.35 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.876 -179.993 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 88' ' ' MET . . . . . 0.621 ' SD ' HD11 ' A' ' 106' ' ' ILE . 5.6 ttm -162.2 172.68 15.39 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.958 -179.941 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 89' ' ' ILE . . . . . 0.507 ' C ' ' CD1' ' A' ' 90' ' ' TRP . 2.8 mt -96.75 141.85 14.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.054 179.912 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 90' ' ' TRP . . . . . 0.584 ' CE3' ' HB ' ' A' ' 106' ' ' ILE . 0.5 OUTLIER -142.89 84.61 1.85 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.84 -179.985 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -38.88 92.23 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.715 -179.935 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . 0.505 ' N ' ' O ' ' A' ' 90' ' ' TRP . 0.1 OUTLIER -81.73 129.29 34.67 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.013 -179.955 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.577 HG23 ' HB ' ' A' ' 80' ' ' THR . 63.3 m -114.8 135.66 53.94 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.086 179.905 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 6.7 t -59.6 88.67 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.097 -179.91 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.479 HG13 ' O ' ' A' ' 93' ' ' THR . 1.3 mt -109.34 87.93 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.282 -179.874 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -176.76 -39.71 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.848 -0.692 . . . . 0.0 112.515 179.942 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 97' ' ' ALA . . . . . 0.619 ' HB1' ' HG3' ' A' ' 63' ' ' GLU . . . 62.68 35.04 14.37 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.842 0.353 . . . . 0.0 111.205 179.932 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 98' ' ' GLY . . . . . 0.442 ' O ' ' HD3' ' A' ' 99' ' ' ARG . . . 140.42 -10.52 2.97 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.59 -0.814 . . . . 0.0 112.677 179.952 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.442 ' HD3' ' O ' ' A' ' 98' ' ' GLY . 0.2 OUTLIER 176.49 -83.29 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.805 0.336 . . . . 0.0 110.793 -179.899 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 0.469 ' O ' ' HB3' ' A' ' 101' ' ' ARG . . . 35.54 -108.32 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.546 179.965 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.564 ' N ' ' CD ' ' A' ' 101' ' ' ARG . 0.0 OUTLIER 176.95 104.59 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.841 0.353 . . . . 0.0 110.92 179.983 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.485 HG21 ' OH ' ' A' ' 81' ' ' TYR . 2.7 mp -52.2 116.42 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.222 179.986 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . 0.473 ' O ' ' HA ' ' A' ' 92' ' ' CYS . 3.8 t -82.26 139.74 34.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.771 179.911 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 104' ' ' CYS . . . . . 0.403 ' HA ' ' HA ' ' A' ' 92' ' ' CYS . 0.5 OUTLIER -114.91 113.41 24.14 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.997 -179.875 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 1.4 p -97.02 109.4 22.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.048 179.809 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.96 HD13 ' N ' ' A' ' 107' ' ' ALA . 0.0 OUTLIER -58.53 150.29 4.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.338 -179.927 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 107' ' ' ALA . . . . . 0.96 ' N ' HD13 ' A' ' 106' ' ' ILE . . . -99.98 126.84 46.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.946 179.822 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 -109.22 -13.25 14.68 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.036 -179.901 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.214 -0.898 . . . . 0.0 110.794 -179.923 . . . . . . . . 1 1 . 1 stop_ save_